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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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182509 76897244 1 SO2N5C12H15 AB2C5D12E15 24.19 4.72 -8.89 -0.82 0
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182510 76897245 1 SO2N3C15H25 AB2C3D15E25 -61.84 3.2 -8.79 0.02 0
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182511 76897838 1 S2O3N5C11H17 A2B3C5D11E17 -92.34 2.43 -8.92 -1.07 0
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182512 76898343 1 SO3N4C13H14 AB3C4D13E14 -79.62 5.87 -9.15 -1.11 0
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182513 76898454 1 OSN4C6H14 ABC4D6E14 -23.97 3.63 -8.92 0.41 0
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182514 76898455 1 O2N4C5H12 A2B4C5D12 -72.12 3.47 -9.78 0.53 0
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182515 76898660 1 OSH5N5C7 ABC5D5E7 106.72 6.05 -9.61 -1.99 0
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182516 76899184 1 OSN2H10C14 ABC2D10E14 41.32 2.76 -8.56 -0.98 0
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182517 76899195 1 BrNOS2H8C13 ABCD2E8F13 44.36 3.44 -8.47 -1.19 0
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182518 76900037 1 ClFSN4O5C29H30 ABCD4E5F29G30 -145.02 5.81 -8.4 -1.35 0
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182519 76900415 1 BrPN3Na4O5H13C17 ABC3D4E5F13G17 -420.7 6.28 -6.82 0.23 0
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182520 76900475 1 ON6C15H18 AB6C15D18 31.07 3.2 -8.76 -0.82 0
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182521 76900617 1 BrO2N6C18H21 AB2C6D18E21 1.29 2.8 -8.75 -0.66 0
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182522 76900631 1 FSO3N8C31H33 ABC3D8E31F33 -61.02 5.46 -9.15 -1.19 0
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182523 76900632 1 FSO3N8H25C27 ABC3D8E25F27 -36.39 4.98 -9.28 -1.17 0
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182524 76900848 1 FO2N7C18H22 AB2C7D18E22 -43.61 1.81 -8.66 -1.12 0
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182525 76900849 1 FON7C18H22 ABC7D18E22 4.75 2.13 -8.93 -1.12 0
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182526 76900860 1 ClF3O3N8C28H28 AB3C3D8E28F28 -174.78 2.16 -8.34 -0.81 0
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182527 76901135 1 ON8C18H18 AB8C18D18 105.67 3.81 -8.68 -1.0 0
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182528 76901136 1 ON7H17C18 AB7C17D18 105.72 1.2 -8.55 -0.8 0
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182529 76901137 1 ClON7H16C18 ABC7D16E18 91.41 2.32 -8.68 -0.99 0
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182530 76901185 1 O2N8H30C31 A2B8C30D31 49.84 3.06 -8.9 -0.68 0
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182531 76901186 1 O2N8H30C31 A2B8C30D31 44.97 8.48 -8.8 -0.97 0
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182532 76901187 1 O2N8H30C31 A2B8C30D31 41.19 7.61 -9.11 -0.84 0
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182533 76901195 1 SN3O3C9H13 AB3C3D9E13 -84.73 5.4 -9.57 -0.66 0
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182534 76901469 1 SN2F3O5H13C16 AB2C3D5E13F16 -298.19 8.84 -9.11 -1.58 0
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182535 76901575 1 ClO3N4H25C27 AB3C4D25E27 -63.09 12.9 -8.52 -0.52 0
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182536 76901677 1 FN3O3H20C23 AB3C3D20E23 -72.32 3.44 -8.76 -0.73 0
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182537 76901740 1 O2N7H21C24 A2B7C21D24 71.87 7.76 -8.3 -1.42 0
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182538 76902074 1 N4O4C29H38 A4B4C29D38 -106.7 7.63 -8.9 -1.3 0
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182540 76902464 1 ON8C18H20 AB8C18D20 97.89 4.17 -8.56 -0.82 0
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182541 76902808 1 ClO3N4C24H27 AB3C4D24E27 -21.16 5.65 -8.29 -0.74 0
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182542 76902809 1 O3N4C25H30 A3B4C25D30 -25.29 2.15 -8.07 -0.64 0
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182543 76903391 1 FSO2N3H20C23 ABC2D3E20F23 -37.62 3.17 -8.67 -0.78 0
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182544 76903621 1 BrNO3C15H18 ABC3D15E18 -95.2 3.53 -9.08 -0.92 0
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182545 76903783 1 ClON3C12H18 ABC3D12E18 2.8 1.94 -8.8 -0.04 0
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182546 76903784 1 ClNO2H16C17 ABC2D16E17 -31.37 7.68 -8.64 -0.86 0
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182547 76903785 1 ClNO2H16C17 ABC2D16E17 -29.05 7.07 -8.94 -0.6 0
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182548 76903786 1 ClNO2H16C17 ABC2D16E17 -33.12 7.92 -8.59 -0.87 0
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182549 76903787 1 ClNO2H16C17 ABC2D16E17 -27.97 5.99 -8.89 -0.27 0
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182550 76903906 1 SN3O3C12H19 AB3C3D12E19 -100.05 9.68 -9.55 -1.01 0
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182551 76905089 2 NO2C7H10 AB2C7D10 -113.0 4.47 -9.09 -0.22 0
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182552 76905198 1 N2F3O3C12H15 A2B3C3D12E15 -220.6 5.09 -8.7 -0.15 0
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182553 76905752 1 ON4C15H22 AB4C15D22 25.31 5.51 -8.5 -1.51 0
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182554 76906002 1 ClSN3O3H10C12 ABC3D3E10F12 -52.22 7.36 -9.43 -1.66 1
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182555 76906026 1 O3N4C14H19 A3B4C14D19 -78.52 2.31 0.0 0.0 0
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182556 76906143 1 NO4C14H17 AB4C14D17 -131.98 5.84 -9.66 -1.13 0
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182557 76906373 1 NO5C15H19 AB5C15D19 -181.14 7.55 -9.46 -1.09 0
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182558 76906432 1 SN2O4H12C14 AB2C4D12E14 -85.83 4.31 -9.32 -1.4 0
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182559 76906512 1 N2O3C16H22 A2B3C16D22 -102.33 6.59 -9.06 -1.21 0