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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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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
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46659 10526025 1 NSO4C23H31 ABC4D23E31 -170.87 11.33 -9.34 -0.77 0
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46660 10526053 2 O4C11H13 A4B11C13 -281.77 3.79 -8.66 0.01 0
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46661 10526056 2 O2H9C14 A2B9C14 -21.89 4.15 -8.15 -1.61 0
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46662 10526075 2 NSH7C13 ABC7D13 247.04 6.88 -8.81 -1.34 0
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46663 10526099 1 N3O5H21C23 A3B5C21D23 -78.28 8.09 -8.44 -0.86 0
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46664 10526100 1 O4N5H21C22 A4B5C21D22 -37.5 3.9 -9.59 -1.18 0
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46665 10526101 1 SN3O6C19H21 AB3C6D19E21 -154.22 10.68 -9.2 -0.9 0
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46666 10526103 1 SO3N5H17C21 AB3C5D17E21 82.14 12.45 -9.17 -1.61 0
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46667 10526119 1 NO3C27H33 AB3C27D33 -66.44 6.33 -9.0 -0.83 0
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46668 10526125 1 NO3C26H45 AB3C26D45 -196.97 3.99 -9.11 0.37 0
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46669 10526127 1 ON5C24H45 AB5C24D45 -33.9 4.45 -8.64 0.15 2
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46670 10526134 1 FeNOSeC19H27 ABCDE19F27 21.73 3.17 -8.14 -0.17 0
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46671 10526144 6 NOC3H4 ABC3D4 -209.26 4.28 -9.64 -1.13 0
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46672 10526146 1 FN2O4H21C24 AB2C4D21E24 -121.28 1.05 -9.56 -0.98 0
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46673 10526149 1 NSeO2C22H31 ABC2D22E31 -78.68 3.29 -8.5 -0.21 0
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46674 10526153 1 SN2O4H20C23 AB2C4D20E23 -73.72 6.19 -8.75 -1.02 0
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46675 10526159 1 N2O4C25H28 A2B4C25D28 -150.0 7.24 -8.85 -0.96 0
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46676 10526161 1 O3N4C24H28 A3B4C24D28 -60.16 1.47 -9.4 -0.8 2
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46678 10526195 1 NO9C20H23 AB9C20D23 -322.69 3.67 -9.39 -1.1 1
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46679 10526201 1 O4N5C22H24 A4B5C22D24 -64.25 6.51 0.0 0.0 0
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46680 10526203 1 O4N5C22H23 A4B5C22D23 -101.52 11.72 -9.4 -0.81 0
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46681 10526204 1 FS2O3N5H16C17 AB2C3D5E16F17 -53.46 4.78 -9.3 -1.27 0
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46682 10526227 1 ClOSN5H16C21 ABCD5E16F21 95.42 5.63 -8.93 -1.42 0
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46683 10526229 1 ClNH24C29 ABC24D29 107.6 1.12 -9.06 -0.46 0
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46684 10526240 2 N2O3C10H15 A2B3C10D15 -212.01 3.27 -9.26 -0.74 0
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46685 10526245 1 ON6H22C25 AB6C22D25 93.96 1.92 -8.35 -0.54 0
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46686 10526260 1 NCl3O7C14H22 AB3C7D14E22 -343.97 4.02 -10.44 -0.68 1
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46687 10526263 1 O3C21H23 A3B21C23 -82.43 1.77 0.0 0.0 0
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46688 10526269 1 P2N3O9C13H19 A2B3C9D13E19 -486.7 2.34 -8.22 -0.07 0
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46689 10526278 1 N3O8C19H25 A3B8C19D25 -315.06 5.49 -8.68 -0.66 0
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46690 10526291 1 NO7C22H33 AB7C22D33 -336.59 2.75 -9.79 -0.4 0
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46691 10526300 1 NSO6C21H29 ABC6D21E29 -275.75 5.05 -9.54 -0.33 0
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46692 10526310 1 NSSiO5C20H29 ABCD5E20F29 -244.02 4.48 -9.03 -0.57 0
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46694 10526331 1 N2O8H16C21 A2B8C16D21 -258.75 5.09 -9.39 -2.27 0
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46695 10526347 4 OH6C7 AB6C7 -2.39 5.25 -9.05 -0.71 0
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46696 10526371 2 NSH10C13 ABC10D13 134.35 2.66 -7.94 -0.47 0
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46697 10526377 1 O3C28H40 A3B28C40 -138.55 5.26 -8.91 -0.2 0
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46698 10526381 1 SiO3C26H36 AB3C26D36 -161.9 2.0 -9.01 -0.07 0
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46699 10526388 1 ClNSeO4H16C18 ABCD4E16F18 -43.04 5.93 -8.96 -1.48 0
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46700 10526410 1 NSO5C23H23 ABC5D23E23 -137.8 10.03 -9.44 -0.81 0
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46701 10526414 1 SO3N5C21H23 AB3C5D21E23 -35.17 1.71 -9.28 -1.05 0
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46702 10526417 1 N3O4C24H31 A3B4C24D31 -117.49 6.87 -9.3 -0.45 0
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46703 10526423 1 ClFSnC18H36 ABCD18E36 -106.96 0.6 -9.34 0.74 0
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46704 10526429 1 ClOPN3C23H25 ABCD3E23F25 -36.8 3.99 -8.66 0.14 0
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46705 10526449 1 O5N6C20H22 A5B6C20D22 -45.79 4.01 -9.33 -1.53 0
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46706 10526451 1 N2O6C23H26 A2B6C23D26 -215.13 3.7 -9.78 -0.49 0
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46707 10526463 2 N2O3C10H17 A2B3C10D17 -258.91 3.56 -9.09 0.26 0
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46708 10526471 1 SN2O3C24H30 AB2C3D24E30 -106.81 2.54 -8.75 -0.64 0
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46709 10526494 1 BrN2O2C22H23 AB2C2D22E23 -16.01 2.22 -9.16 -1.0 0
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46710 10526527 1 ClNSO4H18C22 ABCD4E18F22 -72.5 4.47 -8.88 -1.17 0