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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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328571 126725280 1 O4F5C27H31 A4B5C27D31 -428.95 7.13 -9.43 -0.48 0
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328572 126725291 1 O4F7C35H37 A4B7C35D37 -499.04 11.58 -9.56 -1.1 0
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328573 126725336 1 ClN3O4C33H38 AB3C4D33E38 -134.31 3.34 -9.1 -0.82 0
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328574 126725427 1 O7N9C62H83 A7B9C62D83 -288.85 1.93 -9.19 -0.4 0
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328575 126725434 1 FSO7N9C61H80 ABC7D9E61F80 -333.33 7.93 -8.63 -0.16 0
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328576 126725452 1 ClSO4N5C17H26 ABC4D5E17F26 -105.99 4.34 -8.79 -0.92 0
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328577 126725571 1 FS4N8O8H35C49 AB4C8D8E35F49 18.08 5.96 -8.11 -1.18 0
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328578 126725641 1 ON2C18H20 AB2C18D20 26.05 3.3 -7.94 -0.91 0
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328579 126725643 1 F2O3N7C31H33 A2B3C7D31E33 -101.54 3.79 -8.33 -1.18 0
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328580 126725674 1 NO2C13H13 AB2C13D13 -46.23 4.29 -9.1 -0.72 1
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328581 126725690 1 NO6C13H18 AB6C13D18 -234.73 1.33 0.0 0.0 0
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328582 126725692 2 FNOSC11H12 ABCDE11F12 -164.3 8.1 -8.7 -1.03 0
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328583 126725695 1 F3C13H21 A3B13C21 -185.78 4.02 -10.03 0.38 0
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328584 126725740 1 NO4C11H17 AB4C11D17 -172.79 3.62 -9.82 -0.15 0
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328585 126725741 1 NO4C17H29 AB4C17D29 -218.17 1.77 -9.59 -0.13 0
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328586 126725757 1 NO4C25H49 AB4C25D49 -277.57 0.78 -9.53 0.65 0
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328587 126725787 1 SN2O5H26C27 AB2C5D26E27 -137.23 11.27 -8.39 -1.58 0
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328588 126725795 1 N2O3H34C45 A2B3C34D45 119.02 2.31 -7.78 -0.76 0
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328589 126725812 1 NOC13H23 ABC13D23 -50.69 1.61 -8.46 1.2 0
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328590 126725815 1 NO13C36H41 AB13C36D41 -507.54 4.95 -8.7 -1.68 0
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328591 126725825 2 OSN2H12C16 ABC2D12E16 96.39 0.95 -8.48 -2.6 0
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328592 126725842 2 OC22H25 AB22C25 -65.29 5.06 -8.69 0.24 0
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328593 126725846 1 OC9H20 AB9C20 -89.7 1.92 -10.04 2.93 0
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328594 126725847 1 NC9H21 AB9C21 -40.79 2.07 -9.05 3.58 0
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328595 126725871 1 NH21C22 AB21C22 95.45 3.81 -8.68 -0.93 0
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328596 126725882 1 NH15C22 AB15C22 134.55 2.93 -8.5 -1.28 0
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328597 126725887 1 NOH13C20 ABC13D20 97.48 2.73 -8.99 -0.9 0
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328598 126725889 1 NH17C22 AB17C22 89.19 2.64 -8.8 -0.82 0
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328599 126725892 1 NH17C24 AB17C24 97.55 2.66 -8.34 -1.27 0
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328600 126725896 1 N3O5H19C31 A3B5C19D31 -10.53 4.28 -8.91 -1.14 0
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328601 126725899 1 SN3O4H19C31 AB3C4D19E31 18.71 4.27 -8.58 -1.14 0
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328602 126725900 1 SN3O4H17C27 AB3C4D17E27 6.65 3.97 -8.75 -1.16 0
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328603 126725901 2 N2O2H13C19 A2B2C13D19 45.48 4.1 -8.33 -1.17 0
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328604 126725926 1 SF3N3H22C26 AB3C3D22E26 -60.88 3.8 -8.52 -0.8 0
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328605 126725939 1 PO7C17H35 AB7C17D35 -424.95 4.35 -9.78 0.18 0
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328607 126725945 1 N3O10C57H79 A3B10C57D79 -454.9 4.52 -8.7 -0.81 0
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328608 126725948 1 N3O8C44H59 A3B8C44D59 -368.63 2.11 -8.83 -0.41 0
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328609 126725949 2 N2O4C23H30 A2B4C23D30 -318.43 6.85 -8.15 -0.74 0
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328610 126725950 1 INO2C20H22 ABC2D20E22 -50.45 3.29 -8.21 -0.68 0
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328611 126725951 1 BrN2O2C12H17 AB2C2D12E17 -72.31 1.63 -9.61 -0.38 0
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328612 126725952 1 Br2F3N6O9C56H59 A2B3C6D9E56F59 -393.97 4.17 -8.86 -1.29 0
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328613 126725959 2 N2O4H14C15 A2B4C14D15 -212.53 11.12 -8.49 -1.68 0
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328614 126725964 2 N5O9H32C33 A5B9C32D33 -543.58 12.66 -8.26 -0.62 0
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328615 126725968 1 INO4C20H20 ABC4D20E20 -52.69 6.08 -9.47 -1.65 0
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328616 126725982 2 N2O4H17C20 A2B4C17D20 -85.6 3.64 -9.13 -1.14 0
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328617 126726005 1 N2S2C19H26 A2B2C19D26 39.88 3.22 -8.21 -0.22 0
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328618 126726021 1 O2F7C12H17 A2B7C12D17 -502.37 4.34 -11.13 0.33 0
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328619 126726028 1 O2F3N5H22C24 A2B3C5D22E24 -85.92 10.84 -9.27 -1.07 0
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328620 126726038 1 NC68H85 AB68C85 88.34 2.32 -8.22 -0.62 0
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328621 126726040 1 S2N4O5C28H36 A2B4C5D28E36 -71.02 4.66 -8.66 -2.38 0
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328622 126726046 1 ClN2O3H17C19 AB2C3D17E19 -70.03 0.86 -9.54 -0.63 0
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328623 126726060 1 OSN2C10H18 ABC2D10E18 -29.09 1.95 -8.46 -0.03 0
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328624 126726063 1 OSN2C15H18 ABC2D15E18 4.92 0.49 -8.56 -0.52 0
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328625 126726085 1 NSO5H11C12 ABC5D11E12 -160.2 2.39 -9.64 -1.03 0
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328626 126726093 1 N3O4H21C27 A3B4C21D27 -29.23 4.27 -9.04 -1.07 0
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328627 126726098 1 SN3O6H17C25 AB3C6D17E25 -73.27 5.8 -8.64 -1.07 0
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328628 126726102 1 N3O5H21C27 A3B5C21D27 -60.8 5.5 -8.85 -1.09 0
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328629 126726119 1 N4O4H42C45 A4B4C42D45 -0.55 5.3 -7.9 -1.04 0
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328630 126726121 1 S2N3O4H13C25 A2B3C4D13E25 56.98 3.52 -8.7 -1.31 0
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328631 126726122 1 SN3O4H25C29 AB3C4D25E29 2.09 3.57 -8.97 -1.14 0
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328632 126726136 1 N3O4H19C33 A3B4C19D33 68.3 3.74 -8.37 -1.42 0
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328633 126726154 1 N3O4H25C33 A3B4C25D33 23.86 4.95 -8.73 -1.1 0
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328634 126726155 1 SO2N3H15C34 AB2C3D15E34 342.7 3.4 -9.03 -1.55 0
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328635 126726164 1 SF3N4C18H19 AB3C4D18E19 -75.04 3.97 -9.21 -1.34 0
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328636 126726166 1 SF3N5C17H18 AB3C5D17E18 -61.58 3.31 -9.27 -1.41 0
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328637 126726169 1 F6N6H32C33 A6B6C32D33 -192.8 6.17 -8.26 -0.73 0
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328638 126726177 1 SN7H25C31 AB7C25D31 192.53 11.93 -9.27 -1.73 0
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328639 126726180 1 SF2N4H14C24 AB2C4D14E24 57.59 4.24 -8.91 -1.42 0
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328640 126726196 1 S2N3H13C16 A2B3C13D16 106.9 3.18 -8.59 -0.83 0
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328641 126726201 1 ON3C19H23 AB3C19D23 22.73 2.73 -9.07 -0.34 0
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328642 126726203 1 S2N3H13C19 A2B3C13D19 123.46 3.43 -8.43 -0.97 0
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328643 126726223 1 NO3H17C21 AB3C17D21 15.41 5.15 -8.93 -0.76 0
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328644 126726229 1 N2O3H16C21 A2B3C16D21 36.42 3.13 -9.05 -1.11 0
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328645 126726230 1 SN2O2H16C21 AB2C2D16E21 90.76 3.67 -8.7 -1.45 0
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328646 126726237 1 NO3H17C20 AB3C17D20 -35.62 4.28 -8.54 -0.55 0