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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222126 85294555 1 NO14H43C44 AB14C43D44 -437.42 2.85 -9.58 -0.72 0
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222127 85294558 1 SnSi2O3C42H86 AB2C3D42E86 -328.2 1.52 -8.69 0.84 0
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222128 85294561 1 N4O12C43H52 A4B12C43D52 -479.79 5.01 -9.22 -0.35 0
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222130 85294575 1 N2O16H30C43 A2B16C30D43 -379.85 10.41 -8.06 -3.16 0
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222131 85294578 1 PS2N4O6C45H47 AB2C4D6E45F47 -125.87 6.49 -8.65 -0.51 0
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222132 85294582 1 N5O13C23H45 A5B13C23D45 -601.02 6.23 -9.34 0.76 0
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222133 85294584 1 O14C47H54 A14B47C54 -507.23 3.51 -9.22 -0.09 0
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222134 85294588 1 SN5O8C47H51 AB5C8D47E51 -115.84 6.32 -8.67 -0.88 0
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222135 85294589 9 OC6H6 AB6C6 -176.73 2.21 -9.27 0.02 0
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222136 85294602 1 INSiO10C40H54 ABCD10E40F54 -290.99 20.12 -6.44 -1.36 0
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222137 85294635 1 N2Cl3O17C37H43 A2B3C17D37E43 -715.56 3.05 -9.34 -1.3 0
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222138 85294649 1 N4O20C41H46 A4B20C41D46 -745.25 3.57 -8.78 -1.79 0
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222139 85294651 1 N6O13C23H46 A6B13C23D46 -594.0 6.97 -9.28 0.7 0
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222140 85294660 1 P2N9O17C35H41 A2B9C17D35E41 -637.91 4.6 -9.01 -1.57 0
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222141 85294666 1 NO16C50H57 AB16C50D57 -560.13 10.85 -9.59 -0.66 0
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222142 85294679 1 SiC26H40 AB26C40 -7.88 3.31 -7.8 0.38 0
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222143 85294681 1 N2O27C36H52 A2B27C36D52 -1221.07 13.77 -10.2 -0.4 0
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222144 85294691 1 N3O16C51H55 A3B16C51D55 -600.72 5.46 -8.92 -0.47 0
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222145 85294692 1 O23C44H70 A23B44C70 -970.32 5.23 -8.88 -0.7 0
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222148 85294732 1 N2O24C47H72 A2B24C47D72 -1138.3 5.33 -9.72 0.44 2
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222149 85294739 1 F2N2O14C53H70 A2B2C14D53E70 -543.14 17.21 -6.21 -0.77 1
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222150 85294744 1 N4O5C63H99 A4B5C63D99 -295.64 16.77 0.0 0.0 0
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222153 85294760 1 O23C53H90 A23B53C90 -1114.37 6.54 -9.85 0.7 0
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222154 85294762 1 SN7O12C58H79 AB7C12D58E79 -454.79 8.73 -8.82 -1.1 0
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222155 85294763 1 Si2S4O7C58H106 A2B4C7D58E106 -500.07 1.95 -8.24 0.29 0