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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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390046 134996799 1 NSO6C15H15 ABC6D15E15 -178.68 7.21 -10.43 -1.46 0
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390047 134996800 1 NPSO7C37H38 ABCD7E37F38 -244.82 7.91 -8.52 -1.21 0
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390048 134996807 1 NSSiO2C15H23 ABCD2E15F23 -99.6 3.51 -9.56 -0.43 0
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390049 134996810 1 FNH14C16 ABC14D16 8.76 3.0 -9.01 -0.66 0
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390050 134996816 1 FNOSiC12H16 ABCDE12F16 -86.57 2.67 -9.95 -0.33 0
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390051 134996817 1 NSiO3C14H29 ABC3D14E29 -173.88 3.47 -9.77 1.12 0
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390052 134996821 1 OSN2F3C13H23 ABC2D3E13F23 -185.81 5.33 -8.76 0.0 0
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390053 134996824 1 BPC10H14 ABC10D14 101.71 1.76 -7.65 -0.18 1
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390054 134996825 1 BOPC18H23 ABCD18E23 39.25 6.79 0.0 0.0 0
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390055 134996826 1 O2N5C14H17 A2B5C14D17 -25.93 5.27 -8.95 -1.39 0
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390056 134996841 1 N3C31H43 A3B31C43 34.05 3.15 -9.38 -1.13 0
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390057 134996843 1 ClOSN4H25C32 ABCD4E25F32 144.22 10.9 -7.87 -1.38 0
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390058 134996849 1 O4S5C14H16 A4B5C14D16 -154.82 3.49 -8.85 -2.14 0
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390059 134996867 1 NO6H15C17 AB6C15D17 -124.05 4.45 -8.99 -1.33 0
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390060 134996872 1 O4N5H15C19 A4B5C15D19 71.96 4.1 -9.23 -1.76 0
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390061 134996877 1 NO2C19H23 AB2C19D23 -1.21 2.58 -9.16 -0.01 0
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390062 134996883 1 O4C59H90 A4B59C90 -163.14 3.85 -8.67 -1.66 0
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390063 134996885 1 OSiC17H32 ABC17D32 -98.94 2.35 -8.8 0.92 0
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390064 134996893 1 NOSiC20H25 ABCD20E25 9.15 3.17 -8.1 0.01 0
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390065 134996894 1 BrCrSiO5C28H33 ABCD5E28F33 -211.23 4.1 -7.96 -0.87 0
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390066 134996895 1 CrNO4C18H23 ABC4D18E23 -43.73 6.63 -5.83 0.2 0
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390067 134996896 2 OSC7H9 ABC7D9 -56.95 6.49 -8.05 -0.41 0
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390068 134996897 1 OSC13H18 ABC13D18 -41.26 0.89 -8.5 -0.05 0
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390069 134996904 1 NSC21H21 ABC21D21 85.88 0.45 -8.2 -0.41 0
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390070 134996929 1 N2O2C19H22 A2B2C19D22 -29.59 4.96 -9.17 -1.17 0
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390071 134996930 1 ON2C20H22 AB2C20D22 29.84 2.81 -9.0 -1.32 0
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390072 134996936 1 ON2C21H24 AB2C21D24 12.64 5.53 -9.06 -1.08 0
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390073 134996945 2 PSC8H16 ABC8D16 -161.66 6.78 -8.34 1.52 0
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390074 134996947 2 SiO2C9H20 AB2C9D20 -319.56 2.64 -8.79 0.78 0
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390075 134996954 1 N3C31H41 A3B31C41 59.4 3.18 -9.39 -1.1 0
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390076 134996955 1 ON3H17C22 AB3C17D22 101.28 4.26 -9.0 -1.28 0
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390077 134996956 1 SN4H14C18 AB4C14D18 147.45 2.98 -8.98 -1.84 0
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390078 134996960 1 N6O12C33H46 A6B12C33D46 -337.16 1.51 -9.5 -0.95 0
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390079 134996961 1 NO7C17H19 AB7C17D19 -203.5 5.99 -10.52 -1.44 1
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390080 134996975 1 MnPO2H19C23 ABC2D19E23 174.55 8.22 0.0 0.0 1
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390081 134996976 1 MoPO5H14C21 ABC5D14E21 150.16 8.92 0.0 0.0 1
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390082 134996979 1 PWO5H12C16 ABC5D12E16 23.43 6.2 0.0 0.0 0
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390083 134996986 1 N2O2C15H20 A2B2C15D20 -61.13 2.42 -9.6 -0.87 0
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390084 134996988 1 ON2C9H16 AB2C9D16 8.27 3.41 -8.83 0.48 0
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390085 134996990 1 N2O2C17H22 A2B2C17D22 -61.52 3.45 -9.34 -0.78 0
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390086 134996996 1 SiO6C42H68 AB6C42D68 -375.71 3.8 -8.9 0.23 0
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390087 134997003 1 ClNSO15H54C63 ABCD15E54F63 -425.57 4.76 -9.0 -1.17 0
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390088 134997006 1 FN2S2O23C50H61 AB2C2D23E50F61 -1034.2 4.29 -9.02 -0.6 0
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390089 134997007 1 NSO12C52H53 ABC12D52E53 -365.5 6.22 -9.04 -1.47 0
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390090 134997008 1 N3O7C50H57 A3B7C50D57 -143.26 6.05 -9.15 -1.87 0
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390091 134997014 1 ClN2H13C17 AB2C13D17 87.4 6.24 -9.33 -1.06 0
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390092 134997022 1 CrNO4C20H25 ABC4D20E25 25.71 5.64 -7.79 0.19 -2
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390094 134997033 1 NOC20H29 ABC20D29 -54.93 2.61 -8.58 0.37 0
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390096 134997039 1 S2N3O3C11H15 A2B3C3D11E15 -72.02 4.44 -8.39 -0.89 -1
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390097 134997043 1 AlNOC17H29 ABCD17E29 -26.57 8.52 0.0 0.0 0
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390098 134997083 1 C2H2S5 A2B2C5 38.95 2.03 -8.44 -2.0 0
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390099 134997084 1 OH6S6C8 AB6C6D8 -1.39 1.52 -8.41 -2.1 0
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390100 134997086 1 SeO2S2C12H16 AB2C2D12E16 -34.05 5.47 -7.84 -1.81 0
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390101 134997089 1 NaSN3O3C16H20 ABC3D3E16F20 -131.94 10.39 -9.1 -0.57 0
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390102 134997093 1 OSiN5C26H29 ABC5D26E29 58.16 2.96 -8.92 -0.76 0
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390103 134997097 1 NO3C24H29 AB3C24D29 -85.38 2.7 -9.26 -0.22 0
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390104 134997100 1 FNOH18C21 ABCD18E21 -8.53 4.74 -8.71 -0.18 0
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390105 134997101 1 NO3C23H27 AB3C23D27 -75.32 2.42 -9.22 -0.22 0
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390106 134997104 1 O2C11H12 A2B11C12 -51.18 0.85 -9.02 0.01 0
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390107 134997108 1 NO4C15H19 AB4C15D19 -105.73 3.16 -9.58 -0.09 0
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390108 134997109 1 NO4C29H39 AB4C29D39 -157.94 2.73 -8.98 0.23 0
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390109 134997112 1 NOC15H15 ABC15D15 38.27 1.83 -9.06 -0.39 0
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390110 134997114 1 SiF17O18C77H91 AB17C18D77E91 -1623.01 6.98 -8.96 -0.64 0
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390111 134997115 1 O3F6C8H10 A3B6C8D10 -451.53 4.51 -10.26 -0.22 0
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390112 134997126 1 SN2O4C21H30 AB2C4D21E30 -124.67 8.95 -9.38 -0.11 0
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390114 134997134 1 SiO2C12H22 AB2C12D22 -120.76 2.12 -9.13 0.54 0
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390115 134997135 1 SiO2C16H22 AB2C16D22 -83.41 2.48 -9.01 0.28 0
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390116 134997140 2 O2C7H8 A2B7C8 -141.98 1.88 -8.82 -0.67 0
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390117 134997143 1 OSiC17H26 ABC17D26 -22.67 2.3 -9.12 0.53 0
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390118 134997163 1 SSiO4C19H24 ABC4D19E24 -112.43 8.06 -9.49 -0.55 0
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390119 134997165 1 OSH12C14 ABC12D14 40.92 2.2 -8.72 -0.44 0
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390121 134997168 1 NSC16H19 ABC16D19 61.56 0.55 -8.27 0.07 0
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390122 134997169 1 NSO3C9H19 ABC3D9E19 -143.95 4.82 -9.89 0.1 0
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390123 134997183 1 NO2Si2C18H37 AB2C2D18E37 -186.15 4.55 -8.97 0.74 0
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390124 134997229 1 O5C18H18 A5B18C18 -151.52 0.84 -8.42 -0.2 0