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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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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
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88747 49956489 1 SCl3N3C14H15 AB3C3D14E15 74.85 3.71 0.0 0.0 -1
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88748 49956502 1 SCl2N5C17H18 AB2C5D17E18 154.78 4.64 0.0 0.0 0
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88749 49956509 1 SN2O5H20C23 AB2C5D20E23 -114.82 3.86 -8.74 -1.18 -1
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88750 49956510 1 ClSN2O6C23H24 ABC2D6E23F24 -155.62 3.59 0.0 0.0 -1
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88751 49956512 1 ClNOF3H14C19 ABCD3E14F19 -124.32 4.21 0.0 0.0 -2
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88752 49956513 2 ClNC5H8 ABC5D8 178.87 1.98 -9.04 -8.33 -1
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88753 49956514 1 NOCl2F3H11C14 ABC2D3E11F14 -105.38 6.02 0.0 0.0 -1
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88754 49956515 1 NOCl2C8H10 ABC2D8E10 -28.63 3.19 0.0 0.0 -1
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88755 49956516 1 BrN2O3H10C12 AB2C3D10E12 41.76 6.2 0.0 0.0 -2
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88757 49956522 1 ClON3C28H29 ABC3D28E29 63.18 5.66 0.0 0.0 -1
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88758 49956523 1 ClON2C3H6 ABC2D3E6 3.7 3.67 0.0 0.0 -1
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88759 49956525 1 ClOSN3C13H15 ABCD3E13F15 51.65 1.43 0.0 0.0 -2
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88760 49956529 1 Cl2N2F3C11H13 A2B2C3D11E13 -9.13 58.2 -5.06 -5.06 0
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88761 49956579 1 SN3O4C18H25 AB3C4D18E25 -126.13 5.13 -9.59 -1.58 0
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88762 49956582 1 SN3O6C18H19 AB3C6D18E19 -118.7 6.52 -9.67 -2.06 0
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88763 49956611 1 BrN3O3H18C19 AB3C3D18E19 -34.85 1.85 -9.15 -1.56 0
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88764 49956612 1 O2N3C22H25 A2B3C22D25 -20.33 4.72 -9.08 -0.22 0
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88765 49956645 1 O2N3C23H27 A2B3C23D27 -25.99 3.09 -9.12 -0.22 0
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88766 49956648 1 N3O3H21C23 A3B3C21D23 -29.17 1.81 -8.76 -1.13 0
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88767 49956658 1 NCl3H16C22 AB3C16D22 52.98 4.54 -8.53 -0.77 0
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88768 49956659 1 NCl4H13C18 AB4C13D18 26.17 4.13 -8.65 -0.61 0
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88769 49956662 1 ClN2H15C19 AB2C15D19 81.25 5.09 -8.75 -0.54 0
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88770 49956663 1 ClNO2H18C20 ABC2D18E20 -36.23 3.62 -8.69 -0.52 0
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88771 49956665 1 NCl4H13C18 AB4C13D18 26.11 2.69 -8.67 -0.62 0
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88772 49956666 1 NOC23H25 ABC23D25 -2.52 6.07 -8.45 -0.2 0