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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222682 85317679 1 FO5C16H21 AB5C16D21 -254.44 4.02 -9.68 0.06 0
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222683 85318747 1 NCl3O7C13H16 AB3C7D13E16 -342.43 5.11 -10.52 -0.78 0
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222684 85318748 2 SiO2C10H22 AB2C10D22 -350.0 1.72 -8.91 1.09 0
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222685 85319389 1 NSSi2O4C23H43 ABC2D4E23F43 -277.75 2.82 -8.89 -0.47 0
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222686 85320040 1 SiO6C38H64 AB6C38D64 -370.95 4.47 -8.86 -0.1 0
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222687 85320203 1 NO6C46H53 AB6C46D53 -114.75 2.09 -9.28 -0.48 0
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222688 85320403 1 N9O10C42H61 A9B10C42D61 -440.25 7.02 -8.86 -0.08 0
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222689 85320482 1 N8O13C47H60 A8B13C47D60 -553.17 16.05 -9.3 -0.87 0
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222690 85320483 1 O8H62C63 A8B62C63 -124.64 3.54 -9.15 0.19 0
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222691 85321456 2 NC9H10 AB9C10 47.61 2.08 -8.95 0.3 0
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222693 85321719 1 NSSiO2C13H27 ABCD2E13F27 -134.22 4.11 -9.32 0.55 0
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222694 85322065 1 NSO2C17H35 ABC2D17E35 -146.27 3.68 -8.94 0.26 0
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222695 85322081 1 O2C21H34 A2B21C34 -95.31 2.32 -8.93 0.8 0
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222696 85322109 1 OSiC20H36 ABC20D36 -129.49 0.63 -8.54 1.25 -2
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222698 85326276 1 N4O4C25H26 A4B4C25D26 -79.29 2.27 -8.52 -0.26 0
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222699 85327679 1 FNO11C27H28 ABC11D27E28 -452.93 5.22 -9.25 -2.05 0
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222700 85328166 1 O8N9C34H51 A8B9C34D51 -360.97 6.0 -9.6 -0.24 0
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222701 85330223 1 SN4O5C27H36 AB4C5D27E36 -129.04 4.49 -8.97 -0.75 0
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222702 85330370 1 SCl2N4O7C24H34 AB2C4D7E24F34 -302.51 2.52 -8.87 -1.13 0
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222703 85330574 1 SN9O11C39H53 AB9C11D39E53 -434.51 9.77 -8.72 -0.55 0
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222704 85330689 1 O13N26C52H100 A13B26C52D100 -605.81 5.89 -9.13 -0.3 0
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222705 85331227 1 SN6C22H22 AB6C22D22 135.98 3.49 -8.32 -0.72 0
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222706 85331580 1 BrFN2O2C21H36 ABC2D2E21F36 -71.45 21.37 -6.74 -3.15 0
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222707 85332042 1 FSN3O6C22H28 ABC3D6E22F28 -283.55 6.51 -9.45 -0.69 0
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222708 85332049 1 FN2O7H23C25 AB2C7D23E25 -247.91 5.05 -8.94 -0.84 0
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222709 85332057 1 N2O4C29H42 A2B4C29D42 -182.51 3.07 -8.03 0.19 0
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222710 85332058 1 SO4C29H38 AB4C29D38 -182.75 2.34 -8.36 0.03 0
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222711 85332059 1 O4C31H46 A4B31C46 -183.02 4.2 -8.68 0.04 0
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222712 85332063 1 BrO2N4C24H27 AB2C4D24E27 -41.46 4.7 -8.61 -1.29 0
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222714 85332065 1 N3O6H25C27 A3B6C25D27 -150.89 19.92 -7.6 -1.8 0
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222715 85332074 1 NOS2C29H41 ABC2D29E41 -6.82 0.55 -7.8 -1.37 0
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222716 85332078 4 NOC7H7 ABC7D7 -40.03 9.88 -8.98 -1.69 0
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222717 85332086 1 BrN2S2O4C19H21 AB2C2D4E19F21 -90.64 4.22 -8.83 -0.95 0
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222718 85332091 1 N5O5C25H33 A5B5C25D33 -143.38 11.99 -9.61 -2.33 0
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222719 85332116 1 N3O5C28H29 A3B5C28D29 -85.55 1.27 -8.53 -0.48 0
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222720 85332118 1 F3O4N6C21H31 A3B4C6D21E31 -283.55 7.72 -9.57 -1.22 0
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222721 85332132 3 NO2C9H9 AB2C9D9 -193.6 4.02 -8.7 -0.4 0
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222722 85332149 1 SN2O4C27H42 AB2C4D27E42 -169.31 4.55 -9.62 -0.56 0
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222723 85332152 1 P3N5C10O12H16 A3B5C10D12E16 -658.52 2.56 -8.46 -0.55 0
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222724 85332155 1 FNO6C27H38 ABC6D27E38 -294.46 7.03 -9.59 -0.32 0
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222725 85332164 2 ON5C12H16 AB5C12D16 17.68 5.92 -8.48 -0.64 0
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222726 85332165 2 ON5C12H16 AB5C12D16 25.05 4.63 -8.49 -0.4 0
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222727 85332170 1 ClN2O5C26H37 AB2C5D26E37 -216.37 2.78 -9.55 -0.31 0
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222728 85332173 1 N5O5C26H31 A5B5C26D31 -141.08 6.68 -9.05 -0.95 0
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222729 85332175 1 O3N5H27C29 A3B5C27D29 -16.91 8.01 -8.61 -0.84 0
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222730 85332177 1 N3O3C31H31 A3B3C31D31 -44.54 4.6 -8.57 -0.67 0
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222731 85332182 1 ClNO3C30H36 ABC3D30E36 -134.0 2.65 -8.56 0.18 0
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222732 85332184 1 SF2N4O6H20C21 AB2C4D6E20F21 -238.29 10.33 -9.77 -1.0 0
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222733 85332188 1 O2N5F6C22H23 A2B5C6D22E23 -331.48 10.12 -8.87 -0.96 0
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222734 85332196 1 ON3C33H41 AB3C33D41 1.88 4.28 -8.57 0.14 0