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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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46582 10525366 1 O6N8C15H18 A6B8C15D18 -163.53 8.89 -10.06 -1.52 0
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46583 10525367 1 PO7C20H23 AB7C20D23 -277.63 2.02 -9.43 0.08 0
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46584 10525372 1 N2O3C16H24 A2B3C16D24 -135.5 3.6 -9.02 0.07 0
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46585 10525381 1 NOSeC22H33 ABCD22E33 -42.16 3.29 -8.43 -0.1 0
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46586 10525389 2 NO2C12H13 AB2C12D13 -56.57 6.71 -9.41 -1.22 0
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46587 10525399 2 O2C13H15 A2B13C15 -145.16 5.83 -8.92 -0.44 0
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46588 10525404 1 SN2O6C18H34 AB2C6D18E34 -298.79 1.71 -9.0 -0.14 0
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46589 10525406 1 OSN4C23H26 ABC4D23E26 73.92 6.6 -8.67 -1.09 0
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46590 10525408 1 O5C24H38 A5B24C38 -130.44 1.33 -9.24 0.17 0
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46591 10525411 2 NOC13H17 ABC13D17 -44.62 7.21 -8.44 0.07 0
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46592 10525413 1 SiO3N4C20H34 AB3C4D20E34 -150.78 4.15 -8.69 -0.12 0
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46593 10525415 1 N2O3C24H42 A2B3C24D42 -101.21 3.17 -9.53 0.75 0
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46594 10525462 1 N3O3C24H29 A3B3C24D29 -98.23 6.2 -8.9 -0.56 0
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46595 10525464 1 FSiO2N3C22H22 ABC2D3E22F22 -31.62 4.17 -8.72 -0.84 0
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46596 10525472 1 SN3O3C21H33 AB3C3D21E33 -156.3 7.27 -8.82 -0.31 0
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46598 10525475 1 NO2S2C22H33 AB2C2D22E33 -81.77 2.56 -8.94 -0.12 0
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46599 10525477 1 ClFN3O3C20H23 ABC3D3E20F23 -22.87 69.08 -5.19 -3.07 0
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46600 10525478 1 FN3O3C20H22 AB3C3D20E22 -81.65 8.96 -8.78 -0.75 0
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46601 10525495 1 TcN2S2O5C10H17 AB2C2D5E10F17 26.53 6.74 -7.43 -5.79 0
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46602 10525502 1 O3N8C19H20 A3B8C19D20 115.13 4.86 -9.62 -1.52 0
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46603 10525515 1 N2O6C21H32 A2B6C21D32 -289.7 3.46 -8.86 0.13 1
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46604 10525525 1 NOC21H46 ABC21D46 -92.84 1.84 0.0 0.0 0
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46605 10525527 1 OSN2H20C26 ABC2D20E26 76.18 4.59 -8.7 -0.91 0
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46606 10525529 1 N2O5C22H36 A2B5C22D36 -267.93 6.28 -10.22 -0.67 0
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46607 10525530 1 N2O3C25H32 A2B3C25D32 -97.34 2.55 -9.37 -0.02 0
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46608 10525531 1 N2O3C25H32 A2B3C25D32 -52.18 4.72 -9.24 0.06 0
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46609 10525534 1 SN2O2C24H28 AB2C2D24E28 -42.84 1.76 -8.08 -0.58 0
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46610 10525571 1 SN3O6C18H23 AB3C6D18E23 -153.4 4.63 -10.7 -1.89 0
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46611 10525576 1 N3O4C23H27 A3B4C23D27 -109.1 2.71 -9.35 -0.35 0
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46612 10525579 1 SN3O3C22H23 AB3C3D22E23 -41.42 3.24 -8.21 -0.93 0
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46613 10525581 1 NO4C25H31 AB4C25D31 -170.84 4.59 -9.35 -0.26 0
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46614 10525583 1 NO2H27C28 AB2C27D28 14.79 3.33 -9.28 -0.07 0
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46615 10525586 1 N3O3C24H31 A3B3C24D31 -87.16 5.62 -8.49 0.11 0
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46616 10525625 2 NO2C12H15 AB2C12D15 -137.01 7.17 -9.37 -0.32 0
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46617 10525635 1 SO2N4C22H26 AB2C4D22E26 18.78 6.99 -8.38 -0.8 0
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46618 10525638 1 N2O3C25H34 A2B3C25D34 -168.08 2.44 -9.28 0.28 0
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46619 10525666 1 NO7H21C22 AB7C21D22 -203.22 1.76 -8.66 -1.13 0
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46620 10525675 1 N3O3H21C25 A3B3C21D25 -17.25 11.4 -8.3 -1.58 0
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46621 10525679 1 FN3O3C23H26 AB3C3D23E26 -85.31 4.59 -8.71 -0.83 0
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46622 10525682 1 NO5C24H29 AB5C24D29 -158.67 4.8 -9.14 -0.16 0
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46623 10525711 1 ISiO3C15H29 ABC3D15E29 -198.28 2.43 -8.88 -1.06 0
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46624 10525715 1 PO7C20H27 AB7C20D27 -341.53 1.96 -9.52 0.01 0
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46625 10525716 1 IN2O2Si2C12H25 AB2C2D2E12F25 -168.25 5.53 -8.15 -0.46 0
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46626 10525723 1 SN2O5H20C21 AB2C5D20E21 -141.88 3.6 -9.09 -1.05 0
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46627 10525736 1 N2S3O5C16H16 A2B3C5D16E16 -149.21 3.89 -8.72 -0.85 0
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46628 10525752 1 O3C27H40 A3B27C40 -170.9 7.7 -9.55 0.82 0
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46629 10525753 1 O3C27H40 A3B27C40 -107.56 8.05 -8.9 0.07 0
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46630 10525759 1 ClO2N4C22H25 AB2C4D22E25 -18.22 4.17 -9.1 -0.72 0
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46631 10525760 1 NOSBr2H11C15 ABCD2E11F15 27.21 3.66 -8.37 -1.22 0
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46632 10525766 1 NO3F5H16C20 AB3C5D16E20 -322.94 2.91 -8.66 -1.2 0
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46633 10525771 1 N3O4H19C24 A3B4C19D24 -74.56 5.75 -9.5 -1.97 0
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46634 10525783 1 S2O3N5H15C18 A2B3C5D15E18 6.38 5.99 -8.95 -1.11 0
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46635 10525789 1 SO2N3H19C24 AB2C3D19E24 56.57 6.25 -8.97 -1.2 0
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46636 10525814 1 ClSN5C21H24 ABC5D21E24 81.6 6.02 -8.21 -0.96 0
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46637 10525845 1 N4O5C21H26 A4B5C21D26 -202.48 5.99 -8.78 -0.28 0
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46638 10525847 1 F3O4C22H29 A3B4C22D29 -311.81 3.0 -9.68 -0.27 0
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46639 10525851 1 O8C21H34 A8B21C34 -385.37 5.06 -9.57 0.13 0
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46640 10525853 1 N2O5C23H30 A2B5C23D30 -169.51 1.41 -9.49 -0.06 0
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46641 10525857 1 O5N6C18H34 A5B6C18D34 -139.98 3.92 -9.48 -1.27 0
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46643 10525869 1 S2O6C19H26 A2B6C19D26 -193.83 3.02 -8.64 -0.88 0
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46644 10525894 1 ClO6H19C22 AB6C19D22 -196.99 1.67 -9.06 -1.38 0
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46645 10525897 1 BSeF4C19H21 ABC4D19E21 -286.35 16.22 -10.13 -1.74 0
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46646 10525903 1 BrF2N2O2C18H21 AB2C2D2E18F21 -154.97 5.43 -8.99 -0.56 0
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46647 10525915 1 N3O6C21H25 A3B6C21D25 -161.11 4.54 -9.04 -0.8 0
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46648 10525923 1 BrOSSiC19H31 ABCDE19F31 -102.49 4.15 -8.44 -0.28 0
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46649 10525936 1 ClN5O5H14C18 AB5C5D14E18 -135.42 11.35 -9.59 -1.47 0
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46650 10525949 1 O3N8H16C20 A3B8C16D20 89.5 9.77 -9.11 -1.45 0
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46651 10525959 1 N2O4H24C25 A2B4C24D25 -86.76 6.42 -9.1 -0.88 0
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46652 10525967 1 N2O3C26H28 A2B3C26D28 -56.46 3.8 -8.74 -0.62 0
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46653 10525982 1 O3C27H44 A3B27C44 -153.26 5.37 -9.82 2.27 0
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46654 10525985 1 SiO3C25H40 AB3C25D40 -70.48 6.84 -8.15 -0.74 0
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46655 10525994 1 BrN2O4H17C19 AB2C4D17E19 -110.27 3.99 -9.25 -1.2 2
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46656 10525995 1 FeNSO3H15C21 ABCD3E15F21 128.85 9.74 -8.19 -2.99 0
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46657 10526008 1 NO5H23C25 AB5C23D25 -125.29 3.53 -8.82 -1.09 0
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46658 10526021 1 NSO5C22H27 ABC5D22E27 -188.16 2.96 -9.45 -0.27 0