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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222795 85332523 1 N4O5C30H36 A4B5C30D36 -146.41 2.17 -8.65 -1.08 0
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222796 85332527 2 O3C16H26 A3B16C26 -344.53 4.58 -9.88 0.41 3
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222797 85332529 1 FeSiN3O6C23H35 ABC3D6E23F35 -66.15 6.0 -7.62 -1.24 0
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222798 85332530 1 NS2F5O5H16C22 AB2C5D5E16F22 -358.93 6.35 -9.04 -2.06 0
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222799 85332534 1 F2N3O4H29C30 A2B3C4D29E30 -186.25 2.83 -8.71 -0.81 0
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222800 85332557 1 O2N7C31H41 A2B7C31D41 -9.69 9.92 -8.54 -0.36 0
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222801 85332565 1 ClSN2F3O5C24H26 ABC2D3E5F24G26 -372.38 8.71 -8.5 -0.92 0
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222802 85332567 1 ClF2N4O5C25H27 AB2C4D5E25F27 -214.18 4.39 -8.8 -0.75 0
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222803 85332568 1 O2Cl4N5C22H33 A2B4C5D22E33 -150.69 5.75 -8.64 -0.64 0
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222805 85332579 1 ClO3N5C29H35 AB3C5D29E35 -38.12 3.44 0.0 0.0 0
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222806 85332581 1 BrON5H28C29 ABC5D28E29 65.77 4.77 -8.12 -0.68 1
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222807 85332582 1 ON5H28C29 AB5C28D29 90.94 3.73 0.0 0.0 0
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222808 85332589 2 SN2O3C12H17 AB2C3D12E17 -212.77 7.76 -8.77 -0.32 0
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222809 85332602 2 ON5C14H16 AB5C14D16 55.51 5.09 -8.33 -0.59 0
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222810 85332603 2 ON5C14H16 AB5C14D16 59.36 3.15 -8.82 -0.27 0
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222811 85332604 2 ON5C14H16 AB5C14D16 59.3 0.76 -8.78 -0.4 0
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222812 85332605 1 SN4O4C29H40 AB4C4D29E40 -146.9 6.95 -9.53 -0.54 0
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222813 85332606 1 ClN2F3O4C27H32 AB2C3D4E27F32 -312.99 4.55 -8.02 -0.71 0
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222814 85332607 1 N2F3O4C27H31 A2B3C4D27E31 -276.27 5.48 -7.96 -0.66 0
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222815 85332608 1 SN5O5C27H35 AB5C5D27E35 -126.07 9.46 -8.71 -0.56 0
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222816 85332612 1 SN2O3C33H38 AB2C3D33E38 -44.43 4.01 -7.66 -0.48 0
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222817 85332618 1 O6N7C25H49 A6B7C25D49 -330.37 10.33 -9.36 0.04 0
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222818 85332625 1 SN2O5C30H44 AB2C5D30E44 -199.12 6.8 -8.68 -0.15 0
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222819 85332626 1 SN3O7H23C28 AB3C7D23E28 -193.23 6.71 -8.97 -1.31 0
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222820 85332627 1 SN5O5C28H39 AB5C5D28E39 -174.23 7.78 -8.84 -0.87 0
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222821 85332635 1 OF3N5C30H42 AB3C5D30E42 -191.43 3.84 -8.56 -0.71 0
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222823 85332648 1 NO8C31H33 AB8C31D33 -276.59 0.86 -9.68 -0.64 0
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222824 85332651 1 NO8C30H45 AB8C30D45 -388.73 5.1 -9.91 -0.64 0
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222825 85332652 1 N3O5C31H53 A3B5C31D53 -293.77 7.15 -9.29 -0.29 0
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222826 85332653 1 ClFO2N5C30H31 ABC2D5E30F31 -56.1 5.56 -8.97 -0.95 0
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222827 85332655 1 BN4O6C29H37 AB4C6D29E37 -251.19 3.45 -9.18 -0.96 0
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222829 85332664 1 F3O3N4C29H39 A3B3C4D29E39 -236.68 4.23 -8.53 -0.78 0
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222830 85332668 1 O15H22C24 A15B22C24 -576.01 6.45 -9.25 -1.52 0
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222831 85332670 1 N2O7H26C32 A2B7C26D32 -175.17 7.91 -8.66 -1.24 0
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222832 85332671 1 N2O8C29H46 A2B8C29D46 -359.26 2.84 -8.98 -0.39 0
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222833 85332672 1 N4O5C31H42 A4B5C31D42 -195.82 6.85 -8.29 -0.28 0
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222834 85332675 1 F3O3N5H28C29 A3B3C5D28E29 -184.19 6.26 -8.74 -0.91 0
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222835 85332677 1 O4N5C32H37 A4B5C32D37 -66.34 7.93 -8.63 -0.63 0
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222836 85332688 1 O3N6C32H36 A3B6C32D36 -60.02 5.84 -8.87 -0.53 0
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222837 85332691 1 ClSN4O4C28H35 ABC4D4E28F35 -130.38 7.51 -8.9 -1.01 0
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222838 85332703 1 SF2N4O4C28H28 AB2C4D4E28F28 -188.75 2.32 -8.64 -1.43 0
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222839 85332705 1 ClO11C26H31 AB11C26D31 -441.4 2.49 -9.66 -0.69 0
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222840 85332706 1 N3O9C28H33 A3B9C28D33 -358.84 4.06 -8.78 -0.98 0
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222841 85332707 1 NS2F3O5C26H28 AB2C3D5E26F28 -303.56 9.73 -9.84 -1.26 0
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222842 85332708 1 F3N3O3C31H36 A3B3C3D31E36 -202.32 5.81 -8.87 -0.44 0
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222844 85332713 1 SN2Cl3O9H17C19 AB2C3D9E17F19 -334.74 1.09 -9.5 -1.29 0
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222845 85332715 1 SN4O8C26H28 AB4C8D26E28 -223.45 7.55 -8.55 -0.96 0
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222846 85332716 1 FN4O4C32H33 AB4C4D32E33 -109.66 6.35 -8.71 -1.17 0
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222848 85332731 1 N3F5O7H22C24 A3B5C7D22E24 -463.85 3.11 -9.3 -1.51 0
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222849 85332732 1 NO17C20H33 AB17C20D33 -755.0 10.27 -10.38 -0.02 0