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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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442564 135253057 1 ON10H26C27 AB10C26D27 171.58 7.27 -8.46 -1.27 0
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442565 135253058 1 ClON5C22H26 ABC5D22E26 14.55 2.52 -8.63 -1.05 0
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442566 135253061 1 ClON5C21H24 ABC5D21E24 25.07 2.55 -8.67 -1.16 0
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442567 135253064 1 ClON5C22H26 ABC5D22E26 19.75 2.82 -8.66 -1.16 0
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442568 135253065 1 O2Cl3N4H15C18 A2B3C4D15E18 -13.61 3.56 -9.02 -1.51 0
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442569 135253067 1 Cl2O2N4C21H22 A2B2C4D21E22 -24.04 2.25 -8.77 -1.38 0
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442570 135253068 1 OCl2N3H17C22 AB2C3D17E22 32.11 7.61 -8.81 -0.95 0
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442571 135253070 1 OCl2N5H17C21 AB2C5D17E21 54.33 5.31 -8.92 -1.19 0
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442572 135253073 1 ClON3H20C23 ABC3D20E23 32.84 5.37 -8.5 -0.79 0
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442573 135253075 1 ClON4H17C21 ABC4D17E21 64.26 2.37 -8.67 -1.17 0
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442574 135253076 1 ClO2N5H20C22 AB2C5D20E22 25.59 1.63 -8.66 -1.1 0
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442575 135253079 1 ClO2N4H17C20 AB2C4D17E20 24.3 3.97 -8.64 -1.11 0
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442576 135253080 1 ClON5H18C21 ABC5D18E21 63.77 1.9 -8.68 -1.16 0
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442577 135253081 1 ClON3H24C25 ABC3D24E25 23.28 5.43 -8.54 -0.8 0
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442578 135253133 1 OCl2N4C22H24 AB2C4D22E24 -4.64 9.76 -8.74 -0.81 0
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442579 135253134 1 ClON5H22C23 ABC5D22E23 43.37 5.59 -8.65 -1.08 0
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442580 135253136 1 ClON5H20C22 ABC5D20E22 52.78 2.45 -8.66 -1.11 0
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442581 135253139 1 ClON4H19C21 ABC4D19E21 61.83 4.18 -8.63 -1.05 0
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442582 135253170 1 ClON7H16C18 ABC7D16E18 113.33 6.8 -8.87 -1.52 0
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442583 135253174 1 ClON6C22H27 ABC6D22E27 28.81 3.47 -8.49 -1.04 0
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442584 135253175 1 ClO2N6C23H27 AB2C6D23E27 -19.11 6.46 -8.67 -1.1 0
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442585 135253177 1 ClON6C24H31 ABC6D24E31 18.01 3.41 -8.38 -1.06 0
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442586 135253179 1 O2N4H18C21 A2B4C18D21 38.08 3.47 -8.53 -0.95 0
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442587 135253180 1 O2N6C21H26 A2B6C21D26 -2.08 13.34 -7.9 -1.19 0
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442588 135253183 1 ClO2N6H17C19 AB2C6D17E19 41.67 6.2 -8.3 -0.88 0
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442589 135253185 1 OCl2N6H14C18 AB2C6D14E18 70.53 7.12 -8.85 -1.04 0
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442590 135253186 1 ClON3C20H22 ABC3D20E22 -6.49 5.64 -8.53 -0.79 0
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442591 135253187 1 ClON3C18H18 ABC3D18E18 2.99 5.35 -8.49 -0.8 0
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442592 135253188 1 ClOF3N6H14C19 ABC3D6E14F19 -83.74 9.29 -9.29 -1.16 0
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442593 135253189 1 ClO2N6H19C20 AB2C6D19E20 50.2 9.35 -8.52 -1.29 0
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442594 135253190 1 OCl2N6H16C19 AB2C6D16E19 79.3 7.56 -9.04 -1.45 0
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442595 135253191 1 ClOF3N6H16C20 ABC3D6E16F20 -74.81 8.15 -9.59 -1.56 0
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442596 135253193 1 ClOF3N6H14C19 ABC3D6E14F19 -62.98 7.56 -9.61 -1.61 0
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442597 135253196 1 OCl2N5H19C21 AB2C5D19E21 39.51 8.67 -8.75 -0.82 0
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442598 135253197 1 ClON5C22H22 ABC5D22E22 40.7 6.44 -8.45 -0.67 0
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442599 135253243 1 ClO2N5C22H26 AB2C5D22E26 -27.46 3.12 -8.68 -1.13 0
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442600 135253245 1 ClSO3N4C20H21 ABC3D4E20F21 -64.17 6.07 -8.8 -1.35 0
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442601 135253252 1 ClO2N6H25C27 AB2C6D25E27 50.16 7.15 -8.62 -1.05 0
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442602 135253288 1 ClO2N5C23H26 AB2C5D23E26 -32.88 1.66 -8.69 -1.15 1
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442603 135253297 1 PSN4O9C14H16 ABC4D9E14F16 -246.55 11.32 0.0 0.0 0
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442604 135253300 1 ClFN3H13C15 ABC3D13E15 21.78 3.24 -8.73 -0.99 0
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442605 135253301 1 Cl2N3H13C15 A2B3C13D15 60.35 3.44 -8.71 -1.06 0
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442606 135253303 1 ClN3C16H20 AB3C16D20 47.04 2.74 -8.35 -0.64 0
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442607 135253304 1 BrClN3H9C13 ABC3D9E13 84.44 2.88 -8.89 -1.14 0
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442608 135253306 1 N3C17H23 A3B17C23 46.41 3.52 -8.12 -0.07 0
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442609 135253307 1 ON3C17H23 AB3C17D23 14.81 3.47 -8.12 -0.11 0
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442610 135253308 1 BrClN3H13C15 ABC3D13E15 72.18 3.52 -8.77 -1.09 0
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442611 135253309 1 BrN3C16H20 AB3C16D20 58.23 2.91 -8.39 -0.66 0
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442612 135253354 1 ClN4C15H15 AB4C15D15 76.15 2.83 -9.08 -0.81 1
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442613 135253357 1 PSN3O5C9H11 ABC3D5E9F11 -189.64 10.06 0.0 0.0 0