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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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313482 126614967 1 NO5C23H31 AB5C23D31 -187.87 3.23 -8.95 0.24 0
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313483 126614968 1 IO5N6C30H35 AB5C6D30E35 -119.47 4.65 -9.06 -1.5 0
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313484 126614971 1 SO2N3C26H27 AB2C3D26E27 -14.68 13.4 -8.32 -0.72 0
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313485 126614974 1 NO2C14H25 AB2C14D25 -79.61 2.77 -9.09 -0.29 0
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313486 126614975 1 NO4H25C29 AB4C25D29 -59.19 4.5 -8.47 -0.5 0
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313487 126614987 1 SN3O4H19C23 AB3C4D19E23 -13.35 2.89 -8.9 -1.94 0
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313488 126614988 1 N2O4S4C21H24 A2B4C4D21E24 -111.9 4.82 -8.94 -1.84 0
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313489 126614991 1 ClNO4H24C25 ABC4D24E25 -111.52 6.56 -8.45 -0.23 0
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313490 126614996 1 SN2O2H22C24 AB2C2D22E24 -20.69 9.41 -8.53 -0.84 0
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313491 126614997 1 ClNSO5H20C24 ABCD5E20F24 -134.39 3.15 -8.78 -1.38 0
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313492 126614998 2 NSO2C10H13 ABC2D10E13 -156.05 9.08 -8.71 -0.87 0
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313493 126614999 1 BrFSN2O2H16C22 ABCD2E2F16G22 -42.23 7.46 -8.73 -1.32 0
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313494 126615002 1 N2S3O4C19H24 A2B3C4D19E24 -142.07 6.7 -8.84 -0.86 0
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313495 126615037 1 N2O3C12H24 A2B3C12D24 -140.51 3.73 -9.14 0.91 0
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313496 126615040 1 ON2C15H22 AB2C15D22 -5.49 2.25 -9.32 -0.09 0
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313497 126615106 1 N2O2C23H28 A2B2C23D28 -9.8 2.57 -8.04 -0.16 0
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313498 126615109 4 N2O2C9H11 A2B2C9D11 -239.6 6.84 -8.39 -1.19 0
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313499 126615115 1 SN2O2C10H12 AB2C2D10E12 72.24 21.22 -6.74 -0.34 0
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313500 126615124 2 SC32H39 AB32C39 256.05 1.55 -6.8 -1.59 0
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313501 126615135 1 SF2N3O5C25H31 AB2C3D5E25F31 -250.66 5.01 -7.38 -0.37 0
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313502 126615146 1 N3O7C24H27 A3B7C24D27 -143.55 7.26 -8.5 -1.4 0
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313503 126615147 1 SF2N4O5C23H24 AB2C4D5E23F24 -158.15 5.6 -7.46 -1.35 0
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313504 126615161 1 SN2F4O5C25H28 AB2C4D5E25F28 -349.67 1.22 -7.42 -0.18 0
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313505 126615168 1 O5N6C36H44 A5B6C36D44 -130.8 8.31 -8.22 -1.19 0
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313506 126615181 1 FN3O5C36H40 AB3C5D36E40 -209.79 6.88 -8.58 -0.14 0
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313507 126615182 1 FN3O5C36H40 AB3C5D36E40 -209.23 6.86 -8.74 -0.11 0
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313508 126615183 1 SF2N3O6C26H31 AB2C3D6E26F31 -261.03 4.18 -7.36 -0.09 0
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313509 126615187 1 SF2N3O5C25H31 AB2C3D5E25F31 -252.98 6.29 -7.24 -0.03 0
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313510 126615193 1 SF2N2O5C26H32 AB2C2D5E26F32 -261.75 4.61 -7.29 0.13 0
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313511 126615200 1 FNSO2C9H12 ABCD2E9F12 -1.82 24.16 -6.28 -0.28 0
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313512 126615207 1 FSN2C9H9 ABC2D9E9 9.98 1.24 -9.25 -1.48 0
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313513 126615208 1 NSF2O2C9H11 ABC2D2E9F11 -50.83 24.37 -6.59 -0.36 1
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313514 126615244 1 NO4C15H24 AB4C15D24 -154.5 4.66 0.0 0.0 0
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313515 126615263 2 OC15H29 AB15C29 -175.37 2.6 -9.35 1.33 0
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313516 126615266 1 SF2N2O6C25H30 AB2C2D6E25F30 -297.42 6.44 -7.38 -0.26 0
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313517 126615268 6 OH3C4 AB3C4 -161.36 8.52 -9.03 -1.21 0
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313518 126615274 1 SF2N2O5C26H30 AB2C2D5E26F30 -251.46 3.84 -7.28 -0.2 0
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313519 126615286 1 SF2N2O6C24H28 AB2C2D6E24F28 -219.39 2.24 -5.16 -0.19 0
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313520 126615303 1 N2O5C17H18 A2B5C17D18 -125.43 1.95 -8.98 -0.78 0
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313521 126615304 1 F2N2O5C27H32 A2B2C5D27E32 -301.65 3.62 -8.91 -0.27 0
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313522 126615305 2 O4H15C16 A4B15C16 -174.04 2.45 -8.83 -0.22 0
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313523 126615323 1 SF2N2O5C26H30 AB2C2D5E26F30 -252.94 3.11 -7.29 0.08 0
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313524 126615357 1 F2O2N3H9C16 A2B2C3D9E16 -18.8 6.74 -9.7 -1.45 0
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313525 126615369 1 BrNSO3H18C21 ABCD3E18F21 -32.05 5.0 -8.4 -0.79 0
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313526 126615375 1 NC19H33 AB19C33 -38.87 3.16 -8.81 0.45 0
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313527 126615380 1 O9C43H70 A9B43C70 -465.96 4.72 -7.78 0.24 0
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313528 126615395 2 OC14H27 AB14C27 -161.32 2.86 -9.34 1.36 0
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313529 126615408 1 NSO5C16H19 ABC5D16E19 -149.16 5.01 -8.3 -0.26 0
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313530 126615409 1 NSO3C15H17 ABC3D15E17 -63.44 3.55 -7.87 -0.09 0
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313531 126615432 1 NF2O4H31C33 AB2C4D31E33 -200.66 8.33 -8.93 -0.44 0
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313532 126615441 1 NF2O4H37C39 AB2C4D37E39 -178.22 2.19 -8.7 -0.23 0
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313533 126615490 1 N2O3F7H31C32 A2B3C7D31E32 -452.14 7.9 -8.89 -1.44 0
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313534 126615495 1 N2O3F7C36H39 A2B3C7D36E39 -471.59 3.3 -8.93 -1.42 0
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313535 126615517 1 N2O4F7C34H35 A2B4C7D34E35 -505.01 5.26 -9.06 -1.48 0
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313536 126615560 1 F2O6N8C49H54 A2B6C8D49E54 -246.35 6.98 -8.94 -1.05 0
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313537 126615624 1 FN2O4C35H43 AB2C4D35E43 -213.6 6.18 -8.84 -0.19 0
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313538 126615629 1 FN2O3C39H45 AB2C3D39E45 -114.46 5.69 -8.43 -0.21 0
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313539 126615670 1 FN2O2H31C32 AB2C2D31E32 -68.7 6.94 -9.14 -0.42 0
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313540 126615714 1 FPSO6N7C18H19 ABCD6E7F18G19 -240.04 6.42 -9.07 -1.5 0
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313541 126615724 1 N3O3C11H13 A3B3C11D13 -85.05 3.77 -9.39 -0.44 0
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313542 126615725 1 N3O3C11H13 A3B3C11D13 -85.4 8.89 -9.58 -0.57 0
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313543 126615730 1 O4N10C43H48 A4B10C43D48 -9.09 5.89 -8.36 -1.22 0
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313544 126615732 1 FSN2O2C12H17 ABC2D2E12F17 -110.54 5.01 -9.55 -0.63 0
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313545 126615740 1 NPO6C20H28 ABC6D20E28 -308.31 6.81 -9.01 -0.66 0
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313546 126615750 1 NF2O4H29C32 AB2C4D29E32 -192.7 7.79 -8.91 -0.52 0
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313547 126615786 1 N3O4C14H17 A3B4C14D17 -107.1 4.93 -9.38 -0.63 0
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313548 126615795 1 PSN4O6C11H15 ABC4D6E11F15 -230.95 5.63 -9.81 -1.41 0
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313549 126615801 1 NO2S2H13C19 AB2C2D13E19 14.86 2.78 -8.57 -1.36 0
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313550 126615804 1 N11O12C56H65 A11B12C56D65 -381.71 7.79 -8.88 -0.71 0
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313551 126615805 1 N4O4C19H22 A4B4C19D22 -108.34 4.73 -8.91 -0.85 0
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313552 126615866 1 O6C7H16 A6B7C16 -216.67 1.37 -9.45 0.1 0
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313553 126615871 1 NPO3C9H16 ABC3D9E16 -138.9 2.74 -8.78 0.22 0
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313554 126615873 1 PO3N4C15H17 AB3C4D15E17 -81.28 3.33 -9.27 -1.07 0
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313555 126615876 1 PO3N4C15H17 AB3C4D15E17 -80.38 3.51 -9.26 -1.13 0
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313556 126615880 1 FN3O3C34H34 AB3C3D34E34 -108.22 5.35 -8.69 -0.24 0