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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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223779 85335559 1 N2F3O6C28H32 A2B3C6D28E32 -307.24 22.35 0.0 0.0 0
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223780 85335560 1 FO4N7C28H36 AB4C7D28E36 -103.79 6.5 -8.65 -0.72 0
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223781 85335561 1 FO4N7C28H36 AB4C7D28E36 -100.51 6.92 -8.77 -0.82 0
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223782 85335562 1 FO4N7C28H36 AB4C7D28E36 -131.41 5.01 -8.66 -0.71 0
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223783 85335563 1 FO4N7C28H36 AB4C7D28E36 -129.59 7.04 -8.72 -0.76 2
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223785 85335565 1 SCl3N3O3C25H30 AB3C3D3E25F30 -115.41 0.52 -9.06 -1.37 0
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223786 85335566 1 ClF3O3N4C27H30 AB3C3D4E27F30 -243.93 7.22 -9.23 -0.96 0
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223787 85335568 1 Cl2O5C30H40 A2B5C30D40 -245.85 10.29 -9.83 -0.44 0
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223788 85335569 1 SN4O5C29H36 AB4C5D29E36 -115.42 6.87 -8.98 -0.85 0
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223789 85335570 1 S2O3N6C27H32 A2B3C6D27E32 -25.12 3.83 -8.38 -1.26 0
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223790 85335572 2 N3O4C13H15 A3B4C13D15 -276.81 8.29 -8.78 -0.73 0
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223791 85335573 1 FN4O5H27C31 AB4C5D27E31 -94.81 7.04 -9.12 -0.88 0
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223792 85335575 1 OC40H60 AB40C60 -23.76 3.3 -8.01 -0.05 0
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223793 85335576 1 N5O7C27H51 A5B7C27D51 -391.21 3.24 -9.55 0.1 0
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223794 85335577 1 ClON5C33H40 ABC5D33E40 -0.35 3.38 -8.99 -0.88 0
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223796 85335580 1 ISN5O7H16C17 ABC5D7E16F17 -77.84 3.89 -9.64 -2.49 0
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223797 85335586 1 SF3N3O4C28H34 AB3C3D4E28F34 -337.84 6.26 -8.36 -1.06 0
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223798 85335588 1 ClNO3F7H23C26 ABC3D7E23F26 -436.75 2.44 -9.28 -0.6 0
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223799 85335589 2 NO3C17H17 AB3C17D17 -178.02 5.7 -8.15 -0.44 0
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223800 85335590 1 F2O4N7C28H35 A2B4C7D28E35 -166.07 9.0 -8.72 -0.76 0
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223801 85335591 1 Cl2N5C32H43 A2B5C32D43 34.53 3.08 -8.39 -0.38 0
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223802 85335593 1 Cl2N4O4C29H30 A2B4C4D29E30 -111.5 4.73 -8.56 -0.98 0
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223804 85335595 1 S2O9H26C28 A2B9C26D28 -276.48 5.24 -9.36 -1.45 0
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223805 85335597 1 N3O3F6C28H31 A3B3C6D28E31 -418.66 3.5 -9.31 -1.25 0
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223806 85335598 2 N3O5C12H20 A3B5C12D20 -486.89 11.57 -10.02 -0.31 0
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223807 85335600 1 SO6N7C26H35 AB6C7D26E35 -106.11 3.9 -9.02 -0.71 0
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223808 85335601 1 BrSN4O8C21H27 ABC4D8E21F27 -342.2 2.4 -9.3 -1.1 0
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223810 85335604 1 FS2N4O6C26H29 AB2C4D6E26F29 -218.24 6.97 -8.76 -0.66 0
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223812 85335610 1 NO8H29C34 AB8C29D34 -202.57 3.15 -8.5 -0.71 0
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223813 85335611 1 FSN3O4C32H38 ABC3D4E32F38 -166.88 7.0 -8.85 -0.7 0
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223814 85335612 1 S2F4N4O5H18C24 A2B4C4D5E18F24 -306.78 10.46 -8.86 -1.2 0
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223815 85335614 1 Cl2O3N6C29H38 A2B3C6D29E38 -89.04 4.08 -8.82 -0.75 0
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223816 85335615 1 N5O9C28H31 A5B9C28D31 -313.35 7.11 -8.87 -1.21 0
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223817 85335616 1 F2O4N7C29H37 A2B4C7D29E37 -165.06 8.72 -8.76 -0.83 0
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223818 85335617 1 P3N4C14O15H27 A3B4C14D15E27 -862.33 2.9 -9.68 -0.48 0
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223819 85335618 1 N9O9C23H37 A9B9C23D37 -393.29 8.16 -9.3 0.05 0
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223820 85335620 1 N8O8C25H44 A8B8C25D44 -398.78 4.14 -9.5 0.2 0
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223821 85335621 1 S2O3N6H28C30 A2B3C6D28E30 0.33 8.45 -8.13 -0.88 0
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223822 85335622 1 ClO4C36H53 AB4C36D53 -194.62 4.36 -8.95 -0.56 0
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223823 85335623 1 O3N5F6C27H31 A3B5C6D27E31 -385.18 4.21 -9.55 -1.42 0
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223824 85335624 1 S2F3N3O4C27H34 A2B3C3D4E27F34 -312.14 9.71 -8.8 -1.03 0
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223825 85335626 1 IOSN2H25C30 ABCD2E25F30 98.96 15.1 -6.88 -2.32 0
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223826 85335628 14 OC2H2 AB2C2 -534.88 2.77 -9.34 -1.65 0
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223827 85335629 1 O2N4F7C28H31 A2B4C7D28E31 -425.79 3.24 -9.48 -1.05 0
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223828 85335630 1 O2Cl3N7C27H34 A2B3C7D27E34 -45.45 5.81 -8.78 -0.77 0
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223829 85335632 1 NSSiO3C35H47 ABCD3E35F47 -151.83 3.82 -9.01 -0.28 0
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223831 85335634 1 O4C39H58 A4B39C58 -223.81 1.4 -8.95 -0.88 0
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223832 85335635 1 ClSF2N2O8C25H29 ABC2D2E8F25G29 -397.33 4.65 -9.48 -1.21 0
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223833 85335636 1 ClSF2N2O6C24H27 ABC2D2E6F24G27 -311.46 5.2 -9.54 -1.08 0
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223834 85335637 1 SN3O8C29H41 AB3C8D29E41 -317.73 8.83 -8.72 -0.58 0