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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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47532 10533901 1 SiO17C50H56 AB17C50D56 -651.92 4.37 -8.62 -0.82 0
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47533 10533926 1 N4O12C55H56 A4B12C55D56 -187.66 11.96 -9.2 -1.22 0
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47534 10533931 1 NSO13C52H89 ABC13D52E89 -630.24 8.88 -8.13 -1.52 0
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47535 10533933 1 N4S4O8C49H68 A4B4C8D49E68 -352.86 4.64 -9.06 -0.25 0
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47536 10533935 1 PN6O9H51C55 AB6C9D51E55 -211.23 11.34 -8.78 -0.85 0
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47537 10533973 1 PSN7O9H44C53 ABC7D9E44F53 -179.08 7.44 -9.17 -1.0 0
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47538 10533984 1 NBr2O14C45H53 AB2C14D45E53 -534.43 8.29 -9.84 -1.16 0
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47539 10534009 2 N2O9C25H29 A2B9C25D29 -659.89 10.5 -8.69 -0.25 0
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47540 10534016 2 NO6C29H44 AB6C29D44 -635.21 3.89 -8.58 0.41 0
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47541 10534025 1 PN6O15C46H59 AB6C15D46E59 -689.58 6.17 -9.14 -0.29 0
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47542 10534029 1 N4Si4O9C51H86 A4B4C9D51E86 -517.88 4.15 -8.78 0.0 0
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47543 10534052 4 NO2C16H17 AB2C16D17 -135.37 5.59 -8.99 -0.64 0
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47544 10534058 1 N7O15C50H83 A7B15C50D83 -710.71 10.09 -8.66 -0.29 0
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47545 10534059 1 IO8N10C46H71 AB8C10D46E71 -353.79 5.94 -9.11 -1.14 0
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47546 10534079 1 INO12C53H60 ABC12D53E60 -375.28 3.28 -8.75 -1.16 0
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47547 10534083 2 P2O8C25H25 A2B8C25D25 -771.81 9.67 -9.2 -0.38 0
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47549 10534122 2 O9C28H42 A9B28C42 -820.88 12.05 -9.12 -0.49 0
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47550 10534147 1 N6O13C56H94 A6B13C56D94 -637.0 9.13 -9.17 -0.24 0
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47551 10534154 1 N2Si2O13C57H86 A2B2C13D57E86 -621.47 5.33 -8.1 -0.78 0
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47552 10534156 1 Cl2N2O8H56C65 A2B2C8D56E65 269.28 67.55 -7.83 -3.82 0
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47553 10534181 1 S2N11O12C49H75 A2B11C12D49E75 -549.48 10.86 -8.59 -2.06 0
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47554 10534208 1 N6O13C60H78 A6B13C60D78 -538.37 6.77 -9.11 -0.05 0
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47555 10534268 1 N13O14C52H91 A13B14C52D91 -723.78 11.74 -9.63 -0.36 1
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47556 10534335 1 N8O9C59H91 A8B9C59D91 -406.97 10.2 0.0 0.0 0
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47557 10534338 1 SiO8C75H106 AB8C75D106 -242.9 5.58 -7.65 -0.82 0
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47558 10534340 2 N8O9C24H43 A8B9C24D43 -858.98 8.47 -9.4 -0.67 0
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47560 10534375 1 P2N12O19C51H56 A2B12C19D51E56 -724.42 24.43 -9.03 -1.06 0
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47561 10534377 1 BrSN10O15C53H75 ABC10D15E53F75 -631.86 5.87 -8.56 -1.46 0
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47562 10534389 1 NO19C66H105 AB19C66D105 -920.13 2.04 -9.63 -0.65 0
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47563 10534420 1 O17C75H80 A17B75C80 -340.83 7.54 -8.53 -0.12 0
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47564 10534429 1 N12O13C64H114 A12B13C64D114 -686.05 15.79 -8.95 -0.05 0
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47565 10534431 1 N2O30C57H68 A2B30C57D68 -1295.13 16.02 -9.24 -0.79 0
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47566 10534432 1 P3O16C70H71 A3B16C70D71 -531.4 8.73 -8.32 -1.73 0
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47567 10534433 4 O7C15H23 A7B15C23 -1283.98 2.6 -9.29 -0.15 0
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47568 10534479 1 N2O11S16C45H52 A2B11C16D45E52 -173.23 6.26 -7.87 -2.26 0
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47569 10534480 1 NO34C56H79 AB34C56D79 -1548.68 7.36 -9.67 0.44 0
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47570 10534481 2 NO4C43H62 AB4C43D62 -351.48 2.28 -8.38 -0.41 0
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47571 10534482 1 SO14N19C57H107 AB14C19D57E107 -667.02 8.47 -9.05 -0.44 0
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47572 10534483 2 N4O8C35H54 A4B8C35D54 -771.27 12.33 -9.69 -0.94 0
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47573 10534484 1 O25C67H116 A25B67C116 -1205.42 4.77 -9.56 -0.22 0
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47574 10534485 1 N12O21C62H74 A12B21C62D74 -516.99 8.46 -9.39 -0.68 0
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47575 10534486 2 N3S3O6C32H44 A3B3C6D32E44 -419.44 21.8 -9.16 -0.52 0
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47576 10534487 1 NO35C56H81 AB35C56D81 -1512.97 5.02 -9.1 -0.21 0
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47577 10534488 1 SiO20C75H80 AB20C75D80 -651.46 0.93 -9.28 -0.7 0
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47578 10534489 2 O8C41H44 A8B41C44 -306.71 6.16 -7.9 -1.19 0
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47579 10534490 1 NO20C76H83 AB20C76D83 -667.44 0.87 -8.6 -1.38 0
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47580 10534491 1 ZnN8C88H96 AB8C88D96 563.74 0.37 -8.86 -1.66 0
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47581 10534492 2 N4C44H49 A4B44C49 484.41 6.21 -7.33 -1.94 0
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47582 10534493 2 S4C40H57 A4B40C57 -53.38 2.67 -8.58 -0.75 0
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47584 10534496 2 NO8C28H37 AB8C28D37 -532.2 12.44 -5.69 -0.62 0
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47585 10534497 1 N11O15C70H115 A11B15C70D115 -720.7 6.89 -9.18 -0.49 0
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47586 10534498 2 O15C32H51 A15B32C51 -1405.91 6.35 -9.82 -0.46 0
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47587 10534499 2 N3O3C44H57 A3B3C44D57 -158.06 2.34 -7.77 -2.38 0
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47588 10534500 1 O15N17C65H95 A15B17C65D95 -598.62 2.71 -9.47 -0.13 0
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47589 10534501 2 PN4O8C35H42 AB4C8D35E42 -669.41 8.86 -8.49 -0.92 0
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47590 10534502 1 P2N15O16C62H83 A2B15C16D62E83 -652.09 2.4 -8.85 -0.81 0
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47591 10534503 1 O13N20C64H102 A13B20C64D102 -591.01 13.94 -8.92 -0.63 0
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47592 10534505 1 O27C69H104 A27B69C104 -1185.48 5.07 -9.43 -0.74 0
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47593 10534506 1 NO36C58H79 AB36C58D79 -1562.46 7.09 -9.09 -0.12 0
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47594 10534508 1 O32C63H100 A32B63C100 -1500.03 1.38 -9.11 0.21 0
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47595 10534510 1 O31C64H108 A31B64C108 -1466.88 1.86 -9.26 0.18 0
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47597 10534512 1 S2N11O13C71H97 A2B11C13D71E97 -565.88 12.38 -9.07 -0.86 0
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47598 10534513 3 N4O9C19H32 A4B9C19D32 -1276.42 9.42 -9.98 -0.56 0
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47599 10534514 2 O7N11C31H52 A7B11C31D52 -605.02 4.76 -9.14 -0.28 0
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47600 10534515 1 N13O29C54H87 A13B29C54D87 -1213.06 13.28 -8.79 -1.06 0
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47601 10534516 1 O31C65H106 A31B65C106 -1463.71 3.52 -9.34 0.03 0
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47602 10534517 1 O27C71H102 A27B71C102 -1173.37 9.51 -9.47 -0.92 0
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47603 10534518 2 NO7C42H63 AB7C42D63 -765.98 7.82 -9.41 -0.02 0
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47604 10534519 1 S2N17O17C60H93 A2B17C17D60E93 -783.23 2.72 -8.39 -0.36 0
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47605 10534520 1 O30C67H106 A30B67C106 -1403.65 5.32 -9.15 -0.17 0
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47606 10534521 1 O15N22C62H102 A15B22C62D102 -573.95 6.92 -8.18 -1.05 0
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47607 10534523 1 O30C67H112 A30B67C112 -1436.08 9.56 -9.71 0.24 0
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47608 10534524 1 N2O24C71H132 A2B24C71D132 -1266.62 8.48 -9.22 0.16 0
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47609 10534525 1 NS2O27C66H103 AB2C27D66E103 -1220.61 14.22 -9.33 -0.98 0
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47610 10534526 1 N4O29C66H94 A4B29C66D94 -1250.09 10.92 -9.42 -0.53 0
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47611 10534527 1 N2O12C87H142 A2B12C87D142 -622.83 7.13 -8.53 -1.1 0
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47612 10534528 1 O11N17C72H129 A11B17C72D129 -670.3 9.88 -8.83 -0.18 0
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47613 10534529 1 N2P3O18C77H79 A2B3C18D77E79 -704.08 2.31 -9.33 -0.31 0
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47614 10534530 2 O17C32H51 A17B32C51 -1592.47 7.28 -9.62 0.11 0
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47615 10534531 1 S3O12N18C64H106 A3B12C18D64E106 -443.14 6.08 -8.64 -0.36 0
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47616 10534532 1 N3F17O26C49H58 A3B17C26D49E58 -2032.08 8.81 -9.93 -0.62 0
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47617 10534533 1 S6N9O12C69H89 A6B9C12D69E89 -350.95 17.43 -8.48 -0.56 0
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47618 10534534 1 SO17C86H94 AB17C86D94 -428.8 8.93 -8.64 -0.2 0
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47619 10534535 1 PN3Si3O17C73H126 AB3C3D17E73F126 -960.31 15.96 -8.42 -0.34 0
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47620 10534536 1 N2O38C59H90 A2B38C59D90 -1628.51 8.56 -9.22 -0.63 0
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47621 10534537 1 O31C70H102 A31B70C102 -1386.05 7.11 -9.01 -0.53 0
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47622 10534538 1 S2O39C56H82 A2B39C56D82 -1599.39 8.31 -8.67 -1.15 0
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47623 10534539 1 S2N16O19C63H94 A2B16C19D63E94 -845.11 6.88 -8.59 -0.66 0
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47625 10534541 2 N2O8C42H63 A2B8C42D63 -778.19 4.77 -8.04 -1.84 0
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47626 10534542 2 BrNPO9C33H60 ABCD9E33F60 -1070.5 7.95 -9.54 -0.57 0
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47629 10534545 1 P5O21C76H77 A5B21C76D77 -985.82 7.35 -9.05 -0.3 0
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47630 10534546 1 NO17C90H117 AB17C90D117 -570.57 11.02 -9.19 -1.6 0
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47631 10534547 2 NO17C34H52 AB17C34D52 -1529.63 6.38 -7.59 -0.33 0
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47633 10534549 3 O10C25H38 A10B25C38 -1351.47 8.81 -9.59 -0.87 0
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47634 10534550 1 O35C69H112 A35B69C112 -1649.04 5.43 -9.2 0.3 0
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47635 10534551 4 BO4C23H25 AB4C23D25 -269.26 25.25 -5.93 -2.6 0
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47636 10534552 2 P2N7O18C23H29 A2B7C18D23E29 -1690.71 11.95 -9.62 -1.28 0
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47637 10534553 1 NSiO31C73H99 ABC31D73E99 -1363.54 3.96 -9.28 0.08 0
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47638 10534554 1 N3O23C81H131 A3B23C81D131 -1079.07 7.17 -9.06 -0.84 0
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47640 10534556 1 O16N19C72H133 A16B19C72D133 -880.53 7.27 -9.27 -0.37 0