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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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181488 76750782 1 OF2N7C24H25 AB2C7D24E25 -11.3 5.59 -8.99 -1.27 0
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181489 76750783 1 OF2N6H20C22 AB2C6D20E22 16.05 5.47 -8.94 -1.26 0
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181490 76750784 1 FON7C22H22 ABC7D22E22 58.49 4.06 -8.65 -1.09 0
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181491 76750850 1 FON7C24H26 ABC7D24E26 26.91 4.43 -8.66 -1.11 0
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181492 76750860 1 F2O2N7C21H21 A2B2C7D21E21 -45.14 1.41 -8.64 -1.06 0
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181493 76750889 1 ON5H19C20 AB5C19D20 75.01 1.65 -8.9 -0.41 0
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181494 76750890 1 ON5C25H29 AB5C25D29 67.47 2.12 -8.65 -0.23 0
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181495 76750951 1 N4O4C23H28 A4B4C23D28 -118.83 6.23 -8.7 -0.34 0
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181496 76750952 2 N2O2C12H15 A2B2C12D15 -124.59 2.47 -8.56 -0.18 0
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181497 76750953 1 F3O4N5C18H22 A3B4C5D18E22 -307.84 6.95 -10.03 -0.99 0
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181498 76750954 1 F3O3N5C21H22 A3B3C5D21E22 -215.27 12.05 -9.88 -0.97 0
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181499 76751328 1 NO5C43H73 AB5C43D73 -353.29 3.94 -8.28 0.5 -1
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181500 76751329 1 PN2S2O5C15H30 AB2C2D5E15F30 -256.11 4.6 0.0 0.0 0
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181501 76751817 1 IrN3H30C36 AB3C30D36 245.94 9.17 -9.42 -4.13 0
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181502 76752805 1 BNO7C33H50 ABC7D33E50 -407.8 3.42 -9.45 -0.01 0
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181503 76752887 1 BN3O5C34H54 AB3C5D34E54 -322.41 7.52 -9.48 -0.33 0
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181504 76753563 2 N3C9H11 A3B9C11 78.71 7.01 -8.8 -1.01 0
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181505 76753908 1 FO2C18H23 AB2C18D23 -111.68 0.39 -9.99 -0.57 0
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181506 76753909 1 NO5C19H23 AB5C19D23 -185.5 7.01 -9.48 -0.37 0
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181507 76753910 1 PO4C17H33 AB4C17D33 -229.17 1.15 -9.22 0.86 0
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181508 76753911 1 O7C31H40 A7B31C40 -280.24 6.21 -8.98 -0.35 0
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181509 76753912 1 O5C24H36 A5B24C36 -223.91 3.67 -8.67 0.3 0
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181510 76753913 1 FC14H25 AB14C25 -76.49 1.54 -9.5 1.0 0
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181511 76753914 1 SSi3O6C62H86 AB3C6D62E86 -347.55 5.78 -8.01 -0.22 0
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181512 76754614 1 N3O3H17C23 A3B3C17D23 54.85 6.45 -9.06 -1.52 0
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181513 76754850 1 NSiO12C52H65 ABC12D52E65 -458.59 10.92 -9.12 -0.8 0
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181514 76754851 1 NSiO15C56H69 ABC15D56E69 -592.87 14.15 -9.15 -0.71 0
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181515 76754976 1 O9C24H28 A9B24C28 -364.67 4.66 -9.2 -0.58 0
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181517 76755267 2 PtC2P2H3N3F4 AB2C2D3E3F4 -340.72 16.44 -7.96 -1.08 0
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181518 76755616 1 S2O5N10H42C44 A2B5C10D42E44 -20.16 6.17 -8.84 -1.7 -1
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181520 76755898 1 S2N3O8C37H55 A2B3C8D37E55 -298.5 13.4 -9.41 -1.63 0
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181521 76755899 2 NO2C14H22 AB2C14D22 -120.82 2.41 -9.46 -0.19 0
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181522 76755900 1 NO4C27H43 AB4C27D43 -206.23 3.88 -9.36 0.73 0
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181523 76755901 1 N2O8C43H64 A2B8C43D64 -331.44 3.49 -9.36 -0.63 0
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181524 76756107 1 SN2O9C42H64 AB2C9D42E64 -375.62 6.05 -9.69 -0.6 0
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181525 76756115 1 NF2O6C33H49 AB2C6D33E49 -343.07 3.18 -9.55 -0.07 0
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181526 76756209 1 NO5C29H47 AB5C29D47 -218.35 0.49 -9.38 0.47 0
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181527 76756447 1 N9O13C71H111 A9B13C71D111 -655.17 9.95 -8.42 -0.17 0
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181528 76756467 1 NO10C16H21 AB10C16D21 -402.18 3.83 -10.3 -1.78 1
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181529 76756671 1 BNO4C11H17 ABC4D11E17 -190.15 1.4 0.0 0.0 -2
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181530 76756672 1 N2S2O6H12C17 A2B2C6D12E17 -25.88 48.21 -8.08 -4.48 0
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181531 76756711 1 ClFN3O5C31H39 ABC3D5E31F39 -266.84 6.17 -9.38 -0.5 0
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181532 76757148 2 N2O8C25H33 A2B8C25D33 -688.28 6.52 -9.57 -1.25 0
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181533 76757312 1 ClO2N6H21C22 AB2C6D21E22 23.45 9.31 -8.6 -0.73 0
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181534 76757442 1 BrO2N7H20C21 AB2C7D20E21 50.73 8.26 -8.84 -0.98 0
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181535 76757995 1 O2N9H23C24 A2B9C23D24 96.28 6.99 -8.72 -0.93 0
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181536 76758036 1 SO4N7C21H21 AB4C7D21E21 -34.52 11.21 -8.73 -0.93 0
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181537 76758364 1 SO4N8C24H26 AB4C8D24E26 -27.0 6.24 -8.61 -1.6 0
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181538 76758365 1 SO4N7C21H21 AB4C7D21E21 -26.25 11.02 -8.6 -1.67 0
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181539 76758886 1 O5N7C38H45 A5B7C38D45 -151.19 6.68 -8.81 -1.11 0