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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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88637 49955831 1 ClO2N5C19H21 AB2C5D19E21 85.96 6.86 0.0 0.0 -1
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88638 49955840 1 ClON5C18H21 ABC5D18E21 119.98 7.59 0.0 0.0 -1
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88639 49955842 1 ClON5C17H17 ABC5D17E17 152.86 6.09 0.0 0.0 -1
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88640 49955843 1 ClSO3N6C22H22 ABC3D6E22F22 78.42 1.88 0.0 0.0 -1
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88641 49955855 1 ClO2N5H17C19 AB2C5D17E19 166.88 5.49 0.0 0.0 -1
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88642 49955856 1 ClON5H21C22 ABC5D21E22 149.85 5.79 0.0 0.0 -1
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88643 49955868 1 ClO2N5C20H25 AB2C5D20E25 71.0 9.09 0.0 0.0 -1
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88644 49955869 1 ClO2N5C19H21 AB2C5D19E21 77.48 4.89 0.0 0.0 -1
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88645 49955889 1 ClO2N5C23H23 AB2C5D23E23 116.69 7.7 0.0 0.0 -1
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88646 49955896 1 ClON2C13H22 ABC2D13E22 -1.49 4.79 0.0 0.0 -1
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88647 49955897 1 ClO3N5H17C18 AB3C5D17E18 72.64 5.31 0.0 0.0 -1
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88648 49955905 1 Cl2N2C14H15 A2B2C14D15 69.47 1.34 0.0 0.0 -1
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88649 49955914 1 ClNOC16H27 ABCD16E27 -62.06 1.39 0.0 0.0 -2
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88652 49955925 1 ON2Cl3C18H23 AB2C3D18E23 146.1 6.65 -8.34 -7.38 -2
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88653 49955926 2 ClNOC11H15 ABCD11E15 115.14 14.32 -8.2 -7.3 -2
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88655 49955931 1 ClN2O2C18H18 AB2C2D18E18 5.79 6.85 0.0 0.0 -2
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88656 49955940 1 OSCl2N2C22H22 ABC2D2E22F22 229.84 54.05 -5.09 -5.09 -2
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88657 49955944 1 Cl2N3H13C14 A2B3C13D14 818.82 66.57 -2.25 -1.32 -1
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88658 49955960 1 ClON2C5H8 ABC2D5E8 41.76 4.41 0.0 0.0 -2
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88660 49955972 1 ClNO2F3C15H16 ABC2D3E15F16 -133.67 6.03 0.0 0.0 -1
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88661 49955981 1 ClFO2N5H20C22 ABC2D5E20F22 76.57 6.05 0.0 0.0 -1
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88662 49955982 1 ClO2N5C23H23 AB2C5D23E23 115.65 8.01 0.0 0.0 -1
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88663 49955986 1 NOCl2C12H18 ABC2D12E18 -25.49 2.26 0.0 0.0 -2
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88664 49955987 1 OCl2N2C16H24 AB2C2D16E24 -64.85 7.93 -8.72 0.21 -2
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88666 49956003 1 BrN3C8H15 AB3C8D15 7.02 2.6 0.0 0.0 -1
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88667 49956011 1 ClN2C15H18 AB2C15D18 76.28 3.24 0.0 0.0 -1
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88668 49956030 1 SCl2N2O3C17H21 AB2C2D3E17F21 -60.31 6.08 0.0 0.0 -1
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88669 49956036 1 OCl2N2C19H21 AB2C2D19E21 21.52 4.82 0.0 0.0 -1
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88670 49956039 1 ClNO3H13C19 ABC3D13E19 -1.26 4.92 0.0 0.0 -1
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88671 49956040 1 OSCl2N2C18H21 ABC2D2E18F21 17.76 3.79 0.0 0.0 -1
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88672 49956045 1 ClSN2O4H22C27 ABC2D4E22F27 -42.0 3.14 0.0 0.0 -1
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88673 49956046 1 BrClNOC8H14 ABCDE8F14 -47.1 4.94 0.0 0.0 -1
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88674 49956047 1 BrClN4C8H11 ABC4D8E11 67.01 2.34 0.0 0.0 -1
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88675 49956048 1 ClN2O5H20C26 AB2C5D20E26 -66.15 2.39 0.0 0.0 -2
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88676 49956052 1 Cl2N3C16H19 A2B3C16D19 210.48 9.21 -8.23 -7.29 -1
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88677 49956056 1 N2O2Cl3H20C26 A2B2C3D20E26 -22.91 1.99 0.0 0.0 -1
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88678 49956057 1 ClN2S2O4C17H20 AB2C2D4E17F20 -68.38 2.43 0.0 0.0 -1
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88679 49956058 1 ClON4C22H26 ABC4D22E26 43.79 2.83 0.0 0.0 -1
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88680 49956059 1 ClNO2C18H29 ABC2D18E29 -66.71 3.81 0.0 0.0 -1
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88681 49956060 1 ClNO2C19H19 ABC2D19E19 69.91 1.34 0.0 0.0 -1
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88682 49956061 1 NCl2O2H18C19 AB2C2D18E19 18.48 2.42 0.0 0.0 -1
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88683 49956062 1 ClNO3C21H23 ABC3D21E23 -11.41 4.26 0.0 0.0 -1
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88684 49956063 1 ClNO2C14H17 ABC2D14E17 35.83 1.86 0.0 0.0 -1
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88685 49956064 1 ClNO2C14H17 ABC2D14E17 -3.78 2.57 0.0 0.0 -1
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88686 49956065 1 ClNO2C19H19 ABC2D19E19 68.76 1.62 0.0 0.0 -1
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88687 49956069 1 NCl2O2H18C19 AB2C2D18E19 55.66 1.46 0.0 0.0 -1
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88688 49956086 1 ClN2O4H18C22 AB2C4D18E22 -61.18 3.53 0.0 0.0 -1
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88689 49956091 1 ClN2O3H26C31 AB2C3D26E31 22.4 8.84 0.0 0.0 -1
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88690 49956092 1 ClN2O4H26C31 AB2C4D26E31 -9.17 7.95 0.0 0.0 -1
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88691 49956093 1 ClNO3C12H17 ABC3D12E17 -121.45 1.57 0.0 0.0 -2
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88693 49956106 1 FNCl2H13C15 ABC2D13E15 -9.65 1.25 0.0 0.0 -1
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88694 49956112 1 ClO2N3H7C9 AB2C3D7E9 23.29 3.49 0.0 0.0 -2
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88695 49956116 1 Cl3N4C22H23 A3B4C22D23 235.21 7.81 -8.28 -6.81 -1
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88696 49956117 1 ClNO3C20H25 ABC3D20E25 -57.11 1.28 0.0 0.0 -2
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88697 49956144 1 Cl2N3C19H21 A2B3C19D21 225.44 8.8 -8.38 -6.83 -1
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88698 49956146 1 BrClNOC16H18 ABCDE16F18 32.47 4.4 0.0 0.0 -1
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88699 49956147 1 ClO3N5C14H19 AB3C5D14E19 18.07 6.17 0.0 0.0 -1
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88700 49956148 1 ClNO4C20H25 ABC4D20E25 -111.26 8.27 0.0 0.0 -1
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88701 49956149 1 BrClN2O2C17H21 ABC2D2E17F21 -44.8 7.25 0.0 0.0 -2
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88702 49956154 1 Cl2N2C15H24 A2B2C15D24 138.47 65.45 -4.91 -4.91 -2
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88704 49956183 1 ClN2O3C22H22 AB2C3D22E22 0.58 6.41 0.0 0.0 -1
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88705 49956184 1 NCl2O2C16H18 AB2C2D16E18 -68.3 5.79 0.0 0.0 -2
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88706 49956186 1 Cl2O2N3C14H25 A2B2C3D14E25 -98.81 17.47 -7.59 -1.58 -2
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88707 49956187 1 OSCl2N4C14H16 ABC2D4E14F16 177.02 15.87 -8.11 -7.14 -1
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88708 49956199 1 ClN2O2C18H18 AB2C2D18E18 37.62 1.33 0.0 0.0 -1
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88709 49956204 1 NCl2O2C16H18 AB2C2D16E18 -19.68 5.37 0.0 0.0 -1
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88710 49956222 1 ClOSN2C15H22 ABCD2E15F22 2.69 1.72 0.0 0.0 -1
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88711 49956223 1 Br2N2O2H9C11 A2B2C2D9E11 -47.15 2.77 0.0 0.0 -1
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88712 49956229 1 ClNO3C18H21 ABC3D18E21 -40.28 1.73 0.0 0.0 -2
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88713 49956230 1 Cl2O2N3C15H27 A2B2C3D15E27 13.6 49.93 -5.25 -5.25 -1
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88714 49956242 1 BrClNOC14H20 ABCDE14F20 -1.94 1.85 0.0 0.0 -1
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88715 49956243 1 BrClNOC16H18 ABCDE16F18 35.18 4.01 0.0 0.0 -2
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88716 49956246 1 Cl2N3C13H17 A2B3C13D17 213.47 3.64 -9.09 -8.33 -1
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88717 49956253 1 ClNO5H23C24 ABC5D23E24 -74.41 3.46 0.0 0.0 -1
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88718 49956264 1 NCl3O3H19C21 AB3C3D19E21 -46.0 6.27 0.0 0.0 -1
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88719 49956269 1 BrNOCl3C16H16 ABCD3E16F16 15.54 3.0 0.0 0.0 -2
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88721 49956273 1 OCl3N3C17H18 AB3C3D17E18 113.68 5.01 -9.08 -4.56 -1
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88722 49956278 1 ClFNOC10H14 ABCDE10F14 -70.3 7.17 0.0 0.0 -1
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88723 49956279 1 ClNO3C16H19 ABC3D16E19 -9.6 2.07 0.0 0.0 -1
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88724 49956284 1 NOCl2C16H18 ABC2D16E18 17.92 4.28 0.0 0.0 -1
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88725 49956285 1 ClFNOH18C19 ABCDE18F19 13.03 2.98 0.0 0.0 -1
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88726 49956307 1 OSCl2N3C19H20 ABC2D3E19F20 66.94 2.36 0.0 0.0 -1
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88727 49956311 1 ClNO3C21H23 ABC3D21E23 24.15 1.99 0.0 0.0 -1
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88728 49956316 1 ClNO3C20H25 ABC3D20E25 -28.7 1.61 0.0 0.0 -1
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88729 49956319 1 ClSO2N5C19H23 ABC2D5E19F23 88.52 6.85 0.0 0.0 -1
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88730 49956351 1 ClSF3N5C18H18 ABC3D5E18F18 -2.77 5.12 0.0 0.0 -1
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88731 49956366 1 ClN3O3C22H29 AB3C3D22E29 -12.38 2.85 0.0 0.0 -2
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88733 49956382 1 ClFOSN5H20C21 ABCDE5F20G21 133.9 7.74 0.0 0.0 -2
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88735 49956405 1 N2O2Cl3C12H14 A2B2C3D12E14 -25.83 4.05 0.0 0.0 -1
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88736 49956407 1 ClNOC14H15 ABCD14E15 59.13 1.56 0.0 0.0 -1
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88737 49956414 1 ClNO4C21H21 ABC4D21E21 -31.87 3.36 0.0 0.0 -1
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88738 49956415 1 ClSO3N5C19H23 ABC3D5E19F23 91.27 6.95 0.0 0.0 -1
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88739 49956420 1 ClN3O3C22H29 AB3C3D22E29 -50.29 4.88 0.0 0.0 -1
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88740 49956421 1 ClN3O4C26H29 AB3C4D26E29 -58.68 3.11 0.0 0.0 -1
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88741 49956451 1 ClFN3O3C26H28 ABC3D3E26F28 -57.0 1.32 0.0 0.0 -1
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88742 49956469 1 ClFSN3C14H16 ABCD3E14F16 44.49 2.57 0.0 0.0 -1
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88743 49956472 1 ClOSN3C16H21 ABCD3E16F21 13.54 1.86 0.0 0.0 -1
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88744 49956474 1 ClFNOH18C19 ABCDE18F19 14.63 3.06 0.0 0.0 -1
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88745 49956485 1 ClFNOSH14C16 ABCDEF14G16 54.96 2.13 0.0 0.0 -1
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88746 49956487 1 ClNOC17H21 ABCD17E21 20.18 0.65 0.0 0.0 -1