| 1 | %BASIS "DZP (Dunning)" CARTESIAN | 
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| 2 | basis:( | 
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| 3 | %T.H. DUNNING, JR., J. CHEM. PHYS. 53, 2823 (1970). | 
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| 4 | % T.H. DUNNING, JR. AND P.J. HAY, IN METHODS OF ELECTRONIC STRUCTURE THEORY, | 
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| 5 | % VOL. 2, H.F. SCHAEFER III, ED., PLENUM PRESS (1977). | 
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| 6 | % H - F: T.H. DUNNING JR. AND P.J. HAY, IN METHODS OF ELECTRONIC STRUCTURE | 
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| 7 | %              THEORY VOL. 2, H.F. SCHAEFER III, ED., PLENUM PRESS (1977). | 
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| 8 | %  Si - Cl:    E. MAGNUSSON AND H.F. SCHAEFER III, JCP 83, 5721 (1985). | 
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| 9 | % | 
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| 10 | % | 
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| 11 | % BASIS SET: (4s) -> [2s] | 
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| 12 | hydrogen: "DZP (Dunning)": [ | 
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| 13 | (type: [am = s] | 
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| 14 | {exp coef:0} = { | 
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| 15 | 19.240600000      0.03282800 | 
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| 16 | 2.899200000      0.23120800 | 
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| 17 | 0.653400000      0.81723800 | 
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| 18 | }) | 
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| 19 | (type: [am = s] | 
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| 20 | {exp coef:0} = { | 
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| 21 | 0.177600000      1.00000000 | 
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| 22 | }) | 
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| 23 | % AUGMENTING FUNCTIONS: (1p) | 
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| 24 | (type: [am = p] | 
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| 25 | {exp coef:0} = { | 
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| 26 | 1.00000000      1.00000000 | 
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| 27 | }) | 
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| 28 | ] | 
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| 29 | % | 
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| 30 | % BASIS SET: (9s,4p) -> [4s,2p] | 
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| 31 | lithium: "DZP (Dunning)": [ | 
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| 32 | (type: [am = s] | 
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| 33 | {exp coef:0} = { | 
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| 34 | 921.300000000      0.00136700 | 
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| 35 | 138.700000000      0.01042500 | 
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| 36 | 31.940000000      0.04985900 | 
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| 37 | 9.353000000      0.16070100 | 
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| 38 | 3.158000000      0.34460400 | 
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| 39 | 1.157000000      0.42519700 | 
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| 40 | }) | 
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| 41 | (type: [am = s] | 
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| 42 | {exp coef:0} = { | 
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| 43 | 0.444600000      1.00000000 | 
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| 44 | }) | 
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| 45 | (type: [am = s] | 
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| 46 | {exp coef:0} = { | 
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| 47 | 0.076660000      1.00000000 | 
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| 48 | }) | 
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| 49 | (type: [am = s] | 
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| 50 | {exp coef:0} = { | 
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| 51 | 0.028640000      1.00000000 | 
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| 52 | }) | 
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| 53 | (type: [am = p] | 
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| 54 | {exp coef:0} = { | 
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| 55 | 1.488000000      0.03877000 | 
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| 56 | 0.266700000      0.23625700 | 
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| 57 | 0.072010000      0.83044800 | 
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| 58 | }) | 
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| 59 | (type: [am = p] | 
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| 60 | {exp coef:0} = { | 
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| 61 | 0.023700000      1.00000000 | 
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| 62 | }) | 
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| 63 | % AUGMENTING FUNCTIONS: (1d) | 
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| 64 | (type: [am = d] | 
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| 65 | {exp coef:0} = { | 
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| 66 | 0.20000000      1.00000000 | 
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| 67 | }) | 
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| 68 | ] | 
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| 69 | % | 
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| 70 | % BASIS SET: (9s,5p) -> [4s,2p] | 
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| 71 | boron: "DZP (Dunning)": [ | 
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| 72 | (type: [am = s] | 
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| 73 | {exp coef:0} = { | 
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| 74 | 2788.410000000      0.00212200 | 
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| 75 | 419.039000000      0.01617100 | 
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| 76 | 96.468300000      0.07835600 | 
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| 77 | 28.069400000      0.26325000 | 
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| 78 | 9.376000000      0.59672900 | 
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| 79 | 1.305700000      0.23039700 | 
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| 80 | }) | 
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| 81 | (type: [am = s] | 
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| 82 | {exp coef:0} = { | 
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| 83 | 3.406200000      1.00000000 | 
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| 84 | }) | 
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| 85 | (type: [am = s] | 
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| 86 | {exp coef:0} = { | 
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| 87 | 0.324500000      1.00000000 | 
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| 88 | }) | 
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| 89 | (type: [am = s] | 
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| 90 | {exp coef:0} = { | 
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| 91 | 0.102200000      1.00000000 | 
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| 92 | }) | 
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| 93 | (type: [am = p] | 
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| 94 | {exp coef:0} = { | 
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| 95 | 11.341300000      0.01798700 | 
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| 96 | 2.436000000      0.11033900 | 
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| 97 | 0.683600000      0.38311100 | 
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| 98 | 0.213400000      0.64786000 | 
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| 99 | }) | 
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| 100 | (type: [am = p] | 
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| 101 | {exp coef:0} = { | 
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| 102 | 0.070100000      1.00000000 | 
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| 103 | }) | 
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| 104 | % AUGMENTING FUNCTIONS: (1d) | 
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| 105 | (type: [am = d] | 
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| 106 | {exp coef:0} = { | 
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| 107 | 0.70000000      1.00000000 | 
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| 108 | }) | 
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| 109 | ] | 
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| 110 | % | 
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| 111 | % BASIS SET: (9s,5p) -> [4s,2p] | 
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| 112 | carbon: "DZP (Dunning)": [ | 
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| 113 | (type: [am = s] | 
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| 114 | {exp coef:0} = { | 
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| 115 | 4232.610000000      0.00202900 | 
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| 116 | 634.882000000      0.01553500 | 
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| 117 | 146.097000000      0.07541100 | 
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| 118 | 42.497400000      0.25712100 | 
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| 119 | 14.189200000      0.59655500 | 
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| 120 | 1.966600000      0.24251700 | 
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| 121 | }) | 
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| 122 | (type: [am = s] | 
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| 123 | {exp coef:0} = { | 
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| 124 | 5.147700000      1.00000000 | 
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| 125 | }) | 
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| 126 | (type: [am = s] | 
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| 127 | {exp coef:0} = { | 
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| 128 | 0.496200000      1.00000000 | 
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| 129 | }) | 
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| 130 | (type: [am = s] | 
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| 131 | {exp coef:0} = { | 
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| 132 | 0.153300000      1.00000000 | 
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| 133 | }) | 
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| 134 | (type: [am = p] | 
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| 135 | {exp coef:0} = { | 
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| 136 | 18.155700000      0.01853400 | 
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| 137 | 3.986400000      0.11544200 | 
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| 138 | 1.142900000      0.38620600 | 
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| 139 | 0.359400000      0.64008900 | 
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| 140 | }) | 
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| 141 | (type: [am = p] | 
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| 142 | {exp coef:0} = { | 
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| 143 | 0.114600000      1.00000000 | 
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| 144 | }) | 
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| 145 | % AUGMENTING FUNCTIONS: (1d) | 
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| 146 | (type: [am = d] | 
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| 147 | {exp coef:0} = { | 
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| 148 | 0.75000000      1.00000000 | 
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| 149 | }) | 
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| 150 | ] | 
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| 151 | % | 
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| 152 | % BASIS SET: (9s,5p) -> [4s,2p] | 
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| 153 | nitrogen: "DZP (Dunning)": [ | 
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| 154 | (type: [am = s] | 
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| 155 | {exp coef:0} = { | 
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| 156 | 5909.440000000      0.00200400 | 
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| 157 | 887.451000000      0.01531000 | 
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| 158 | 204.749000000      0.07429300 | 
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| 159 | 59.837600000      0.25336400 | 
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| 160 | 19.998100000      0.60057600 | 
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| 161 | 2.686000000      0.24511100 | 
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| 162 | }) | 
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| 163 | (type: [am = s] | 
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| 164 | {exp coef:0} = { | 
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| 165 | 7.192700000      1.00000000 | 
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| 166 | }) | 
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| 167 | (type: [am = s] | 
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| 168 | {exp coef:0} = { | 
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| 169 | 0.700000000      1.00000000 | 
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| 170 | }) | 
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| 171 | (type: [am = s] | 
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| 172 | {exp coef:0} = { | 
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| 173 | 0.213300000      1.00000000 | 
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| 174 | }) | 
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| 175 | (type: [am = p] | 
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| 176 | {exp coef:0} = { | 
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| 177 | 26.786000000      0.01825700 | 
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| 178 | 5.956400000      0.11640700 | 
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| 179 | 1.707400000      0.39011100 | 
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| 180 | 0.531400000      0.63722100 | 
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| 181 | }) | 
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| 182 | (type: [am = p] | 
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| 183 | {exp coef:0} = { | 
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| 184 | 0.165400000      1.00000000 | 
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| 185 | }) | 
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| 186 | % AUGMENTING FUNCTIONS: (1d) | 
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| 187 | (type: [am = d] | 
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| 188 | {exp coef:0} = { | 
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| 189 | 0.80000000      1.00000000 | 
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| 190 | }) | 
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| 191 | ] | 
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| 192 | % | 
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| 193 | % BASIS SET: (9s,5p) -> [4s,2p] | 
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| 194 | oxygen: "DZP (Dunning)": [ | 
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| 195 | (type: [am = s] | 
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| 196 | {exp coef:0} = { | 
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| 197 | 7816.540000000      0.00203100 | 
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| 198 | 1175.820000000      0.01543600 | 
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| 199 | 273.188000000      0.07377100 | 
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| 200 | 81.169600000      0.24760600 | 
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| 201 | 27.183600000      0.61183200 | 
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| 202 | 3.413600000      0.24120500 | 
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| 203 | }) | 
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| 204 | (type: [am = s] | 
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| 205 | {exp coef:0} = { | 
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| 206 | 9.532200000      1.00000000 | 
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| 207 | }) | 
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| 208 | (type: [am = s] | 
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| 209 | {exp coef:0} = { | 
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| 210 | 0.939800000      1.00000000 | 
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| 211 | }) | 
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| 212 | (type: [am = s] | 
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| 213 | {exp coef:0} = { | 
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| 214 | 0.284600000      1.00000000 | 
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| 215 | }) | 
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| 216 | (type: [am = p] | 
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| 217 | {exp coef:0} = { | 
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| 218 | 35.183200000      0.01958000 | 
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| 219 | 7.904000000      0.12418900 | 
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| 220 | 2.305100000      0.39472700 | 
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| 221 | 0.717100000      0.62737500 | 
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| 222 | }) | 
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| 223 | (type: [am = p] | 
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| 224 | {exp coef:0} = { | 
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| 225 | 0.213700000      1.00000000 | 
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| 226 | }) | 
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| 227 | % AUGMENTING FUNCTIONS: (1d) | 
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| 228 | (type: [am = d] | 
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| 229 | {exp coef:0} = { | 
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| 230 | 0.85000000      1.00000000 | 
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| 231 | }) | 
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| 232 | ] | 
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| 233 | % | 
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| 234 | % BASIS SET: (9s,5p) -> [4s,2p] | 
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| 235 | fluorine: "DZP (Dunning)": [ | 
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| 236 | (type: [am = s] | 
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| 237 | {exp coef:0} = { | 
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| 238 | 9994.790000000      0.00201700 | 
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| 239 | 1506.030000000      0.01529500 | 
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| 240 | 350.269000000      0.07311000 | 
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| 241 | 104.053000000      0.24642000 | 
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| 242 | 34.843200000      0.61259300 | 
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| 243 | 4.368800000      0.24248900 | 
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| 244 | }) | 
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| 245 | (type: [am = s] | 
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| 246 | {exp coef:0} = { | 
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| 247 | 12.216400000      1.00000000 | 
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| 248 | }) | 
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| 249 | (type: [am = s] | 
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| 250 | {exp coef:0} = { | 
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| 251 | 1.207800000      1.00000000 | 
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| 252 | }) | 
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| 253 | (type: [am = s] | 
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| 254 | {exp coef:0} = { | 
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| 255 | 0.363400000      1.00000000 | 
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| 256 | }) | 
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| 257 | (type: [am = p] | 
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| 258 | {exp coef:0} = { | 
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| 259 | 44.355500000      0.02086800 | 
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| 260 | 10.082000000      0.13009200 | 
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| 261 | 2.995900000      0.39621900 | 
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| 262 | 0.938300000      0.62036800 | 
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| 263 | }) | 
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| 264 | (type: [am = p] | 
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| 265 | {exp coef:0} = { | 
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| 266 | 0.273300000      1.00000000 | 
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| 267 | }) | 
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| 268 | % AUGMENTING FUNCTIONS: (1d) | 
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| 269 | (type: [am = d] | 
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| 270 | {exp coef:0} = { | 
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| 271 | 0.90000000      1.00000000 | 
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| 272 | }) | 
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| 273 | ] | 
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| 274 | % | 
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| 275 | % BASIS SET: (9s,5p) -> [4s,2p] | 
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| 276 | neon: "DZP (Dunning)": [ | 
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| 277 | (type: [am = s] | 
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| 278 | {exp coef:0} = { | 
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| 279 | 12100.000000000      0.00120000 | 
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| 280 | 1821.000000000      0.00909200 | 
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| 281 | 432.800000000      0.04130500 | 
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| 282 | 132.500000000      0.13786700 | 
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| 283 | 43.770000000      0.36243300 | 
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| 284 | 14.910000000      0.47224700 | 
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| 285 | 5.127000000      0.13003500 | 
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| 286 | }) | 
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| 287 | (type: [am = s] | 
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| 288 | {exp coef:0} = { | 
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| 289 | 14.910000000      1.00000000 | 
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| 290 | }) | 
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| 291 | (type: [am = s] | 
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| 292 | {exp coef:0} = { | 
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| 293 | 1.491000000      1.00000000 | 
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| 294 | }) | 
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| 295 | (type: [am = s] | 
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| 296 | {exp coef:0} = { | 
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| 297 | 0.446800000      1.00000000 | 
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| 298 | }) | 
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| 299 | (type: [am = p] | 
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| 300 | {exp coef:0} = { | 
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| 301 | 56.450000000      0.02087500 | 
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| 302 | 12.920000000      0.13003200 | 
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| 303 | 3.865000000      0.39567900 | 
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| 304 | 1.203000000      0.62145000 | 
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| 305 | }) | 
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| 306 | (type: [am = p] | 
|---|
| 307 | {exp coef:0} = { | 
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| 308 | 0.344400000      1.00000000 | 
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| 309 | }) | 
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| 310 | % AUGMENTING FUNCTIONS: (1d) | 
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| 311 | (type: [am = d] | 
|---|
| 312 | {exp coef:0} = { | 
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| 313 | 0.95000000      1.00000000 | 
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| 314 | }) | 
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| 315 | ] | 
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| 316 | % | 
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| 317 | % BASIS SET: (11s,7p) -> [6s,4p] | 
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| 318 | aluminum: "DZP (Dunning)": [ | 
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| 319 | (type: [am = s] | 
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| 320 | {exp coef:0} = { | 
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| 321 | 23490.000000000      0.00250900 | 
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| 322 | 3548.000000000      0.01898600 | 
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| 323 | 823.500000000      0.09291400 | 
|---|
| 324 | 237.700000000      0.33593500 | 
|---|
| 325 | 78.600000000      0.64739100 | 
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| 326 | }) | 
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| 327 | (type: [am = s] | 
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| 328 | {exp coef:0} = { | 
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| 329 | 78.600000000      0.11193700 | 
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| 330 | 29.050000000      0.65597600 | 
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| 331 | 11.620000000      0.28334900 | 
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| 332 | }) | 
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| 333 | (type: [am = s] | 
|---|
| 334 | {exp coef:0} = { | 
|---|
| 335 | 3.465000000      1.00000000 | 
|---|
| 336 | }) | 
|---|
| 337 | (type: [am = s] | 
|---|
| 338 | {exp coef:0} = { | 
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| 339 | 1.233000000      1.00000000 | 
|---|
| 340 | }) | 
|---|
| 341 | (type: [am = s] | 
|---|
| 342 | {exp coef:0} = { | 
|---|
| 343 | 0.201800000      1.00000000 | 
|---|
| 344 | }) | 
|---|
| 345 | (type: [am = s] | 
|---|
| 346 | {exp coef:0} = { | 
|---|
| 347 | 0.078050000      1.00000000 | 
|---|
| 348 | }) | 
|---|
| 349 | (type: [am = p] | 
|---|
| 350 | {exp coef:0} = { | 
|---|
| 351 | 141.500000000      0.01788200 | 
|---|
| 352 | 33.220000000      0.12037500 | 
|---|
| 353 | 10.390000000      0.41158000 | 
|---|
| 354 | 3.593000000      0.59535300 | 
|---|
| 355 | }) | 
|---|
| 356 | (type: [am = p] | 
|---|
| 357 | {exp coef:0} = { | 
|---|
| 358 | 3.593000000      0.21175800 | 
|---|
| 359 | 1.242000000      0.83779500 | 
|---|
| 360 | }) | 
|---|
| 361 | (type: [am = p] | 
|---|
| 362 | {exp coef:0} = { | 
|---|
| 363 | 0.304000000      1.00000000 | 
|---|
| 364 | }) | 
|---|
| 365 | (type: [am = p] | 
|---|
| 366 | {exp coef:0} = { | 
|---|
| 367 | 0.076290000      1.00000000 | 
|---|
| 368 | }) | 
|---|
| 369 | % AUGMENTING FUNCTIONS: (1d) | 
|---|
| 370 | (type: [am = d] | 
|---|
| 371 | {exp coef:0} = { | 
|---|
| 372 | 0.32500000      1.00000000 | 
|---|
| 373 | }) | 
|---|
| 374 | ] | 
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| 375 | % | 
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| 376 | % BASIS SET: (11s,7p) -> [6s,4p] | 
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| 377 | silicon: "DZP (Dunning)": [ | 
|---|
| 378 | (type: [am = s] | 
|---|
| 379 | {exp coef:0} = { | 
|---|
| 380 | 26740.000000000      0.00258300 | 
|---|
| 381 | 4076.000000000      0.01923700 | 
|---|
| 382 | 953.300000000      0.09384300 | 
|---|
| 383 | 274.600000000      0.34123500 | 
|---|
| 384 | 90.680000000      0.64167500 | 
|---|
| 385 | }) | 
|---|
| 386 | (type: [am = s] | 
|---|
| 387 | {exp coef:0} = { | 
|---|
| 388 | 90.680000000      0.12143900 | 
|---|
| 389 | 33.530000000      0.65314300 | 
|---|
| 390 | 13.460000000      0.27762400 | 
|---|
| 391 | }) | 
|---|
| 392 | (type: [am = s] | 
|---|
| 393 | {exp coef:0} = { | 
|---|
| 394 | 4.051000000      1.00000000 | 
|---|
| 395 | }) | 
|---|
| 396 | (type: [am = s] | 
|---|
| 397 | {exp coef:0} = { | 
|---|
| 398 | 1.484000000      1.00000000 | 
|---|
| 399 | }) | 
|---|
| 400 | (type: [am = s] | 
|---|
| 401 | {exp coef:0} = { | 
|---|
| 402 | 0.270400000      1.00000000 | 
|---|
| 403 | }) | 
|---|
| 404 | (type: [am = s] | 
|---|
| 405 | {exp coef:0} = { | 
|---|
| 406 | 0.099320000      1.00000000 | 
|---|
| 407 | }) | 
|---|
| 408 | (type: [am = p] | 
|---|
| 409 | {exp coef:0} = { | 
|---|
| 410 | 163.700000000      0.01149800 | 
|---|
| 411 | 38.350000000      0.07772600 | 
|---|
| 412 | 12.020000000      0.26359500 | 
|---|
| 413 | 4.185000000      0.75826900 | 
|---|
| 414 | }) | 
|---|
| 415 | (type: [am = p] | 
|---|
| 416 | {exp coef:0} = { | 
|---|
| 417 | 4.185000000     -1.17304500 | 
|---|
| 418 | 1.483000000      1.43833500 | 
|---|
| 419 | }) | 
|---|
| 420 | (type: [am = p] | 
|---|
| 421 | {exp coef:0} = { | 
|---|
| 422 | 0.335000000      1.00000000 | 
|---|
| 423 | }) | 
|---|
| 424 | (type: [am = p] | 
|---|
| 425 | {exp coef:0} = { | 
|---|
| 426 | 0.096990000      1.00000000 | 
|---|
| 427 | }) | 
|---|
| 428 | % AUGMENTING FUNCTIONS: (1d) | 
|---|
| 429 | (type: [am = d] | 
|---|
| 430 | {exp coef:0} = { | 
|---|
| 431 | 0.55000000      1.00000000 | 
|---|
| 432 | }) | 
|---|
| 433 | ] | 
|---|
| 434 | % | 
|---|
| 435 | % BASIS SET: (11s,7p) -> [6s,4p] | 
|---|
| 436 | phosphorus: "DZP (Dunning)": [ | 
|---|
| 437 | (type: [am = s] | 
|---|
| 438 | {exp coef:0} = { | 
|---|
| 439 | 30630.000000000      0.00261900 | 
|---|
| 440 | 4684.000000000      0.01947900 | 
|---|
| 441 | 1094.000000000      0.09520700 | 
|---|
| 442 | 315.300000000      0.34574200 | 
|---|
| 443 | 104.100000000      0.63628800 | 
|---|
| 444 | }) | 
|---|
| 445 | (type: [am = s] | 
|---|
| 446 | {exp coef:0} = { | 
|---|
| 447 | 104.100000000      0.13070600 | 
|---|
| 448 | 38.420000000      0.65027400 | 
|---|
| 449 | 15.450000000      0.27230800 | 
|---|
| 450 | }) | 
|---|
| 451 | (type: [am = s] | 
|---|
| 452 | {exp coef:0} = { | 
|---|
| 453 | 4.656000000      1.00000000 | 
|---|
| 454 | }) | 
|---|
| 455 | (type: [am = s] | 
|---|
| 456 | {exp coef:0} = { | 
|---|
| 457 | 1.759000000      1.00000000 | 
|---|
| 458 | }) | 
|---|
| 459 | (type: [am = s] | 
|---|
| 460 | {exp coef:0} = { | 
|---|
| 461 | 0.340900000      1.00000000 | 
|---|
| 462 | }) | 
|---|
| 463 | (type: [am = s] | 
|---|
| 464 | {exp coef:0} = { | 
|---|
| 465 | 0.123800000      1.00000000 | 
|---|
| 466 | }) | 
|---|
| 467 | (type: [am = p] | 
|---|
| 468 | {exp coef:0} = { | 
|---|
| 469 | 187.700000000      0.01315800 | 
|---|
| 470 | 43.630000000      0.09049400 | 
|---|
| 471 | 13.600000000      0.30505400 | 
|---|
| 472 | 4.766000000      0.71357900 | 
|---|
| 473 | }) | 
|---|
| 474 | (type: [am = p] | 
|---|
| 475 | {exp coef:0} = { | 
|---|
| 476 | 4.766000000     -0.79257300 | 
|---|
| 477 | 1.743000000      1.42998700 | 
|---|
| 478 | }) | 
|---|
| 479 | (type: [am = p] | 
|---|
| 480 | {exp coef:0} = { | 
|---|
| 481 | 0.419200000      1.00000000 | 
|---|
| 482 | }) | 
|---|
| 483 | (type: [am = p] | 
|---|
| 484 | {exp coef:0} = { | 
|---|
| 485 | 0.124500000      1.00000000 | 
|---|
| 486 | }) | 
|---|
| 487 | % AUGMENTING FUNCTIONS: (1d) | 
|---|
| 488 | (type: [am = d] | 
|---|
| 489 | {exp coef:0} = { | 
|---|
| 490 | 0.60000000      1.00000000 | 
|---|
| 491 | }) | 
|---|
| 492 | ] | 
|---|
| 493 | % | 
|---|
| 494 | % BASIS SET: (11s,7p) -> [6s,4p] | 
|---|
| 495 | sulfur: "DZP (Dunning)": [ | 
|---|
| 496 | (type: [am = s] | 
|---|
| 497 | {exp coef:0} = { | 
|---|
| 498 | 35710.000000000      0.00256500 | 
|---|
| 499 | 5397.000000000      0.01940500 | 
|---|
| 500 | 1250.000000000      0.09559500 | 
|---|
| 501 | 359.900000000      0.34579300 | 
|---|
| 502 | 119.200000000      0.63579400 | 
|---|
| 503 | }) | 
|---|
| 504 | (type: [am = s] | 
|---|
| 505 | {exp coef:0} = { | 
|---|
| 506 | 119.200000000      0.13009600 | 
|---|
| 507 | 43.980000000      0.65130100 | 
|---|
| 508 | 17.630000000      0.27195500 | 
|---|
| 509 | }) | 
|---|
| 510 | (type: [am = s] | 
|---|
| 511 | {exp coef:0} = { | 
|---|
| 512 | 5.420000000      1.00000000 | 
|---|
| 513 | }) | 
|---|
| 514 | (type: [am = s] | 
|---|
| 515 | {exp coef:0} = { | 
|---|
| 516 | 2.074000000      1.00000000 | 
|---|
| 517 | }) | 
|---|
| 518 | (type: [am = s] | 
|---|
| 519 | {exp coef:0} = { | 
|---|
| 520 | 0.424600000      1.00000000 | 
|---|
| 521 | }) | 
|---|
| 522 | (type: [am = s] | 
|---|
| 523 | {exp coef:0} = { | 
|---|
| 524 | 0.151900000      1.00000000 | 
|---|
| 525 | }) | 
|---|
| 526 | (type: [am = p] | 
|---|
| 527 | {exp coef:0} = { | 
|---|
| 528 | 212.900000000      0.01409100 | 
|---|
| 529 | 49.600000000      0.09668500 | 
|---|
| 530 | 15.520000000      0.32387400 | 
|---|
| 531 | 5.476000000      0.69175600 | 
|---|
| 532 | }) | 
|---|
| 533 | (type: [am = p] | 
|---|
| 534 | {exp coef:0} = { | 
|---|
| 535 | 5.476000000     -0.62673700 | 
|---|
| 536 | 2.044000000      1.37705100 | 
|---|
| 537 | }) | 
|---|
| 538 | (type: [am = p] | 
|---|
| 539 | {exp coef:0} = { | 
|---|
| 540 | 0.521800000      1.00000000 | 
|---|
| 541 | }) | 
|---|
| 542 | (type: [am = p] | 
|---|
| 543 | {exp coef:0} = { | 
|---|
| 544 | 0.150600000      1.00000000 | 
|---|
| 545 | }) | 
|---|
| 546 | % AUGMENTING FUNCTIONS: (1d) | 
|---|
| 547 | (type: [am = d] | 
|---|
| 548 | {exp coef:0} = { | 
|---|
| 549 | 0.70000000      1.00000000 | 
|---|
| 550 | }) | 
|---|
| 551 | ] | 
|---|
| 552 | % | 
|---|
| 553 | % BASIS SET: (11s,7p) -> [6s,4p] | 
|---|
| 554 | chlorine: "DZP (Dunning)": [ | 
|---|
| 555 | (type: [am = s] | 
|---|
| 556 | {exp coef:0} = { | 
|---|
| 557 | 40850.000000000      0.00253200 | 
|---|
| 558 | 6179.000000000      0.01920700 | 
|---|
| 559 | 1425.000000000      0.09525700 | 
|---|
| 560 | 409.200000000      0.34558900 | 
|---|
| 561 | 135.500000000      0.63640100 | 
|---|
| 562 | }) | 
|---|
| 563 | (type: [am = s] | 
|---|
| 564 | {exp coef:0} = { | 
|---|
| 565 | 135.500000000      0.12095600 | 
|---|
| 566 | 50.130000000      0.64851100 | 
|---|
| 567 | 20.210000000      0.27548700 | 
|---|
| 568 | }) | 
|---|
| 569 | (type: [am = s] | 
|---|
| 570 | {exp coef:0} = { | 
|---|
| 571 | 6.283000000      1.00000000 | 
|---|
| 572 | }) | 
|---|
| 573 | (type: [am = s] | 
|---|
| 574 | {exp coef:0} = { | 
|---|
| 575 | 2.460000000      1.00000000 | 
|---|
| 576 | }) | 
|---|
| 577 | (type: [am = s] | 
|---|
| 578 | {exp coef:0} = { | 
|---|
| 579 | 0.527100000      1.00000000 | 
|---|
| 580 | }) | 
|---|
| 581 | (type: [am = s] | 
|---|
| 582 | {exp coef:0} = { | 
|---|
| 583 | 0.188400000      1.00000000 | 
|---|
| 584 | }) | 
|---|
| 585 | (type: [am = p] | 
|---|
| 586 | {exp coef:0} = { | 
|---|
| 587 | 240.800000000      0.01459500 | 
|---|
| 588 | 56.560000000      0.09904700 | 
|---|
| 589 | 17.850000000      0.33046200 | 
|---|
| 590 | 6.350000000      0.68287400 | 
|---|
| 591 | }) | 
|---|
| 592 | (type: [am = p] | 
|---|
| 593 | {exp coef:0} = { | 
|---|
| 594 | 6.350000000     -0.56178500 | 
|---|
| 595 | 2.403000000      1.35190100 | 
|---|
| 596 | }) | 
|---|
| 597 | (type: [am = p] | 
|---|
| 598 | {exp coef:0} = { | 
|---|
| 599 | 0.641000000      1.00000000 | 
|---|
| 600 | }) | 
|---|
| 601 | (type: [am = p] | 
|---|
| 602 | {exp coef:0} = { | 
|---|
| 603 | 0.183800000      1.00000000 | 
|---|
| 604 | }) | 
|---|
| 605 | % AUGMENTING FUNCTIONS: (1d) | 
|---|
| 606 | (type: [am = d] | 
|---|
| 607 | {exp coef:0} = { | 
|---|
| 608 | 0.75000000      1.00000000 | 
|---|
| 609 | }) | 
|---|
| 610 | ] | 
|---|
| 611 | ) | 
|---|