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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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181949 76819030 1 FN2O7C40H43 AB2C7D40E43 -277.33 10.15 -9.03 -0.7 2
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181950 76819547 1 ClOSN3C28H38 ABCD3E28F38 -15.89 11.64 -7.27 0.05 0
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181951 76819548 1 ClOSN3C28H36 ABCD3E28F36 -28.89 5.97 -8.9 -0.55 1
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181952 76819837 1 N2O2C31H41 A2B2C31D41 -43.93 2.71 0.0 0.0 0
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181953 76820546 1 BrO3N5H22C24 AB3C5D22E24 10.23 10.28 -9.31 -1.97 0
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181954 76820547 1 SiO3N4C31H38 AB3C4D31E38 -91.49 9.11 -9.27 -1.61 0
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181955 76820548 1 N4O5C23H28 A4B5C23D28 -57.3 7.12 -9.23 -2.48 0
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181956 76820549 1 N3O4H17C19 A3B4C17D19 -38.13 6.54 -9.69 -2.52 0
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181957 76820588 1 O3N4H12C15 A3B4C12D15 20.17 8.89 -10.36 -2.87 0
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181958 76820916 1 O2N3F4H19C23 A2B3C4D19E23 -189.79 10.03 -9.48 -0.98 0
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181959 76820917 1 F2N2O4C21H26 A2B2C4D21E26 -267.38 10.65 -9.19 -0.55 0
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181960 76821243 1 O3F4N4C23H26 A3B4C4D23E26 -311.62 5.65 -8.92 -0.84 0
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181961 76821244 1 ClN4O5C24H29 AB4C5D24E29 -188.2 4.9 -8.4 -0.51 0
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181962 76821245 1 Cl2O2N4F6H18C25 A2B2C4D6E18F25 -347.01 4.72 -9.56 -1.09 0
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181963 76821370 2 ON2C12H16 AB2C12D16 -77.98 4.16 -8.61 -0.15 0
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181964 76821406 1 ClO2F3N4C21H22 AB2C3D4E21F22 -224.71 1.06 -9.4 -0.89 0
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181965 76821407 1 ClF3N4O5C23H24 AB3C4D5E23F24 -352.09 4.73 -9.1 -0.57 0
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181966 76821408 1 ClN4O5C25H27 AB4C5D25E27 -172.13 3.52 -8.76 -0.54 1
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181967 76821492 1 PN3O3C11H17 AB3C3D11E17 -136.46 4.81 0.0 0.0 0
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181968 76822004 1 ClFNO2C16H21 ABCD2E16F21 -162.96 0.26 -9.54 -0.47 0
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181969 76822005 1 FNO4C29H38 ABC4D29E38 -206.83 3.63 -9.0 -0.39 0
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181970 76822006 1 ClNF2O4C27H34 ABC2D4E27F34 -274.58 2.63 -8.96 -0.75 0
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181971 76822007 1 NCl2O4C28H37 AB2C4D28E37 -196.41 3.06 -8.81 -0.24 0
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181972 76822103 1 ClNO4C29H40 ABC4D29E40 -197.21 2.48 -8.7 0.07 0
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181973 76822104 1 FNO5C32H46 ABC5D32E46 -280.65 2.94 -8.62 0.14 0
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181974 76822105 1 FNO4C28H38 ABC4D28E38 -224.47 4.55 -8.82 0.12 0
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181975 76822433 1 NF2O2C17H23 AB2C2D17E23 -208.29 1.72 -9.22 0.16 0
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181976 76822434 1 ClO4C18H23 AB4C18D23 -131.05 2.42 -9.58 -1.02 0
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181977 76822435 1 FNO4C27H36 ABC4D27E36 -215.32 1.5 -8.95 0.02 0
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181978 76822436 1 ClNO4C29H40 ABC4D29E40 -189.52 4.63 -9.08 0.09 0
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181979 76822437 1 NF2O4C30H41 AB2C4D30E41 -282.63 4.14 -8.9 -0.07 0
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181980 76822489 1 N2S2O7H30C34 A2B2C7D30E34 -197.7 5.81 -8.97 -1.21 0
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181981 76822585 1 FN4O4C37H39 AB4C4D37E39 -129.49 7.46 -8.55 -0.99 0
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181982 76822659 1 OCl2N6F7H9C18 AB2C6D7E9F18 -278.35 2.57 -9.36 -1.56 0
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181983 76822660 1 ClOF4N7H20C25 ABC4D7E20F25 -110.3 3.35 -8.75 -1.0 0
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181987 76822980 1 FO2N4C24H27 AB2C4D24E27 -26.01 5.52 -8.7 -0.25 0
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181988 76823082 2 N2O4C13H20 A2B4C13D20 -354.23 5.43 -9.51 -0.45 0
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181989 76823083 1 N4O8C27H42 A4B8C27D42 -368.56 7.39 -9.8 -0.17 0
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181990 76823084 1 OF3N4H9C11 AB3C4D9E11 -85.41 4.02 -10.02 -2.98 0
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181991 76823085 1 N3O7C33H47 A3B7C33D47 -338.64 6.07 -9.48 -0.24 0
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181992 76823442 1 O3N4C22H24 A3B4C22D24 5.77 5.75 -8.22 -2.14 0
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181993 76823656 1 O2N7H21C26 A2B7C21D26 111.49 1.89 -9.09 -2.02 0
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181994 76823950 1 FNSO5H20C21 ABCD5E20F21 -205.79 9.92 -8.28 -1.02 0
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181995 76824171 1 NOH19C23 ABC19D23 58.69 2.7 -8.17 -0.79 0
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181996 76824571 1 O2F3N4C24H29 A2B3C4D24E29 -181.63 5.36 -8.68 -1.39 0
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181997 76824572 1 ClN2O4C26H33 AB2C4D26E33 -141.03 4.97 -8.17 0.01 0
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181998 76825339 1 NCl2O5C14H15 AB2C5D14E15 -197.27 5.22 -9.29 -0.6 0
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181999 76825651 1 O7C51H68 A7B51C68 -174.59 4.06 -9.19 -0.44 0
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182000 76825652 1 FN2O5C33H39 AB2C5D33E39 -234.12 4.91 -8.37 -0.18 0
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182001 76825876 1 FN6O13C61H77 AB6C13D61E77 -464.64 7.5 -7.4 -0.77 0