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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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192937 78326411 1 SN2O4H16C18 AB2C4D16E18 -62.63 6.31 -9.15 -1.55 -1
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192938 78326412 1 SO2N8C16H17 AB2C8D16E17 121.28 2.78 0.0 0.0 1
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192939 78326413 1 SO2N4F6H15C19 AB2C4D6E15F19 -319.01 5.51 0.0 0.0 0
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192940 78326414 1 O13C30H36 A13B30C36 -541.03 3.69 -8.49 -0.42 0
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192941 78326415 1 SO3N5C7H9 AB3C5D7E9 -9.56 5.87 -10.26 -2.45 0
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192942 78326416 1 SO2N4C37H42 AB2C4D37E42 -36.21 3.33 -9.07 -0.97 0
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192943 78326417 1 ClN2O8C29H35 AB2C8D29E35 -236.66 8.31 -8.88 -1.69 0
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192944 78326418 1 OSN4C11H16 ABC4D11E16 3.78 4.61 -8.73 -0.31 0
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192945 78326419 1 ClSN3O4C23H34 ABC3D4E23F34 -179.63 7.63 -9.25 -0.25 0
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192946 78326420 1 ClSN3O4C24H36 ABC3D4E24F36 -186.28 5.05 -9.3 -0.4 0
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192947 78326479 1 BrClSN2O2H16C19 ABCD2E2F16G19 -13.57 2.86 -8.74 -0.65 0
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192948 78326480 1 FN2O3C25H27 AB2C3D25E27 -137.79 7.15 -8.44 -0.7 0
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192949 78326481 1 SN3O8C31H37 AB3C8D31E37 -209.7 8.09 -9.34 -1.84 0
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192950 78326611 1 SN4O4C29H30 AB4C4D29E30 -47.49 11.33 -9.3 -1.16 1
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192951 78327023 1 S2O3N6C19H25 A2B3C6D19E25 -44.86 5.13 0.0 0.0 0
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192952 78328496 1 NF2O4H19C22 AB2C4D19E22 -180.28 1.95 -9.68 -1.21 0
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192953 78329131 1 SN3O7C23H23 AB3C7D23E23 -187.84 7.49 -9.17 -2.03 1
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192954 78329132 1 O2N3C24H38 A2B3C24D38 -60.58 2.41 0.0 0.0 0
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192955 78329133 1 SN3O4C22H23 AB3C4D22E23 -78.33 7.99 -9.46 -1.59 0
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192956 78329134 1 N2O3C21H22 A2B3C21D22 -51.81 4.06 -9.01 -1.4 1
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192957 78329135 1 ClO2N6C19H20 AB2C6D19E20 15.76 3.27 0.0 0.0 0
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192958 78329228 1 O3N5C24H31 A3B5C24D31 -80.64 6.9 -9.19 -0.33 0
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192959 78329229 1 ClFN2O3H18C22 ABC2D3E18F22 -93.96 3.72 -9.4 -1.3 0
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192960 78329547 1 SO3N4C12H12 AB3C4D12E12 -6.82 4.88 -8.98 -1.03 0
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192961 78329548 1 N4O4C27H30 A4B4C27D30 -30.2 7.54 -8.08 -0.22 1