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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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32026 4253497 1 O2N3H15C16 A2B3C15D16 -4.03 4.1 -9.5 -1.08 0
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32027 4253510 1 N2O5H22C33 A2B5C22D33 91.55 2.85 -8.63 -1.48 0
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32028 4253551 2 N2O3C11H15 A2B3C11D15 -233.4 0.92 -7.99 -0.77 0
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32029 4253599 1 ClON3C21H22 ABC3D21E22 37.64 3.03 -8.13 -0.37 0
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32030 4253622 1 ClF3N3S3H19C26 AB3C3D3E19F26 -67.09 3.77 -8.65 -1.26 0
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32031 4253695 1 OSN5H23C25 ABC5D23E25 104.96 6.9 -8.68 -1.04 0
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32032 4253788 1 N2O4C15H28 A2B4C15D28 -230.96 4.93 -9.28 0.83 0
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32033 4253820 1 ON4C23H26 AB4C23D26 17.66 7.71 -8.95 -0.56 0
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32034 4253834 1 FSO2N3C25H28 ABC2D3E25F28 -66.45 3.95 -8.79 -0.57 0
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32035 4253864 1 ClN2S2O3H17C20 AB2C2D3E17F20 -55.76 7.38 -8.93 -1.17 0
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32036 4253958 1 ON3C24H27 AB3C24D27 39.93 5.31 -8.53 0.08 0
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32037 4253983 1 O2N3C36H43 A2B3C36D43 -21.45 3.42 -8.63 0.0 0
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32038 4254058 1 SO2N5C12H15 AB2C5D12E15 16.92 7.54 -9.38 -0.98 0
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32039 4254062 1 NF2C18H19 AB2C18D19 -69.01 1.99 -8.36 -0.24 0
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32040 4254084 1 N4O11C47H56 A4B11C47D56 -130.11 7.43 -8.88 -1.51 0
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32041 4254109 1 NO5C18H19 AB5C18D19 -143.43 4.76 -8.46 0.01 0
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32042 4254123 1 O3N4C26H30 A3B4C26D30 -95.43 9.05 -9.15 -0.39 0
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32043 4254159 1 N4O5C27H34 A4B5C27D34 -149.67 1.69 -8.11 -0.66 0
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32044 4254198 1 OSN4F7H19C26 ABC4D7E19F26 -292.9 6.85 -9.02 -1.34 0
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32045 4254221 1 SN2O3C21H24 AB2C3D21E24 -60.82 4.95 -9.28 -1.07 0
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32046 4254230 2 O2S2N3H17C21 A2B2C3D17E21 38.51 9.13 -8.44 -0.98 0
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32047 4254244 1 N2S2O4H18C21 A2B2C4D18E21 -102.03 4.94 -8.82 -1.4 1
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32048 4254262 1 N4C7H9 A4B7C9 52.36 4.93 0.0 0.0 0
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32049 4254338 1 BrN2O5C20H23 AB2C5D20E23 -201.46 4.09 -9.88 -0.69 0
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32050 4254360 1 NF3O3H14C21 AB3C3D14E21 -217.32 7.06 -9.19 -1.12 0
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32051 4254369 1 ClON2S2H17C20 ABC2D2E17F20 34.87 2.65 -8.67 -0.88 0
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32052 4254372 1 SO2N5H13C15 AB2C5D13E15 39.15 5.11 -9.12 -1.14 0
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32053 4254381 1 SN3O5H15C19 AB3C5D15E19 59.81 8.03 -9.28 -2.22 0
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32054 4254404 1 FN2O4H37C38 AB2C4D37E38 -138.38 5.77 -9.25 -0.66 0
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32055 4254409 1 SF2O4N5H19C25 AB2C4D5E19F25 -110.73 4.64 -8.85 -1.23 0
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32056 4254759 1 S2N4O4H18C23 A2B4C4D18E23 -4.08 5.54 -8.32 -1.4 0
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32057 4255217 1 ClO2N4C22H23 AB2C4D22E23 1.2 5.91 -8.76 -0.94 0
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32058 4255435 1 N3C14H15 A3B14C15 77.51 4.92 -8.27 -0.53 0
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32059 4259929 1 ClON5H20C24 ABC5D20E24 92.44 6.66 -9.16 -1.7 0
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32060 4262837 1 ClSN5O5C23H24 ABC5D5E23F24 -69.16 6.76 -8.99 -1.71 0
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32061 4264355 1 FON4C23H23 ABC4D23E23 -0.08 4.6 -9.15 -0.24 0
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32062 4265933 1 Cl3N3O3H18C19 A3B3C3D18E19 -81.53 7.78 -9.1 -0.95 0
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32063 4265935 1 ON4H18C21 AB4C18D21 110.1 6.73 -8.6 -1.96 0
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32064 4265936 1 NSO2C18H19 ABC2D18E19 -25.35 6.33 -9.32 -0.81 0
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32065 4265946 2 ON2C14H21 AB2C14D21 -88.16 5.18 -8.8 -0.29 0
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32066 4265947 1 ClNS2O4H26C28 ABC2D4E26F28 -65.16 4.81 -8.65 -1.66 0
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32067 4265949 1 BrN3O3H18C20 AB3C3D18E20 -14.46 4.89 -8.56 -0.69 0
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32068 4265950 1 FSO2N3H14C18 ABC2D3E14F18 -5.63 5.75 -9.05 -1.23 0
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32069 4265951 1 NOC21H31 ABC21D31 -54.15 1.7 -7.76 0.51 0
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32070 4265953 1 BrON3H22C24 ABC3D22E24 72.15 4.21 -8.71 -0.4 0
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32071 4265954 1 N3H23C24 A3B23C24 96.81 4.0 -8.53 -0.32 0
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32072 4265955 1 ClN2O2C13H17 AB2C2D13E17 -87.59 5.32 -8.61 0.0 0
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32073 4265956 1 ClN5O7H14C21 AB5C7D14E21 -29.82 16.42 -9.74 -1.74 0
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32074 4265957 1 F3O3N4H19C23 A3B3C4D19E23 -193.2 3.85 -8.89 -1.13 0
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32075 4265958 1 BrN2O5H17C24 AB2C5D17E24 -35.2 5.44 -9.4 -1.42 0
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32076 4265961 2 NO3C19H26 AB3C19D26 -223.96 10.13 -9.46 -1.29 0
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32077 4265962 1 SN2H12C15 AB2C12D15 75.11 4.57 -8.52 -0.52 0
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32078 4265963 1 N3O14H53C55 A3B14C53D55 -396.93 4.01 -8.98 -0.6 0
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32079 4265966 2 NC7H8 AB7C8 47.17 1.93 -8.64 -0.63 0
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32080 4265968 1 N4O5H20C25 A4B5C20D25 -48.71 4.58 -8.8 -1.09 0
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32081 4265969 1 SN2O2Cl4H12C21 AB2C2D4E12F21 -11.1 3.05 -9.05 -1.31 0
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32082 4265970 1 BrOSN2C19H19 ABCD2E19F19 4.89 4.53 -8.92 -1.31 0
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32083 4265972 1 BrSO2N3C21H24 ABC2D3E21F24 -22.39 9.01 -8.22 -0.62 0
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32084 4265973 1 N2O2H20C21 A2B2C20D21 -9.43 4.27 -8.66 -0.5 0
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32085 4265975 1 N3O5H23C27 A3B5C23D27 -5.32 2.87 -8.43 -1.49 0
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32086 4265981 1 N3O4C18H21 A3B4C18D21 -131.51 3.93 -9.58 -1.31 0
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32087 4265988 1 NO5C25H25 AB5C25D25 -143.27 4.08 -8.9 -0.21 0
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32088 4265999 1 N4O4H12C17 A4B4C12D17 31.86 10.01 -9.15 -1.78 0
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32089 4266003 1 BrO2S2N4H13C18 AB2C2D4E13F18 36.86 6.71 -8.76 -1.75 0
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32090 4266010 1 NSiC28H35 ABC28D35 27.06 2.84 -7.93 -0.08 0
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32091 4266013 1 NC22H27 AB22C27 27.76 2.86 -8.21 0.09 0
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32092 4266038 1 N2O3C19H30 A2B3C19D30 -144.69 3.5 -8.83 0.77 0
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32093 4266045 1 FSN2O2H25C28 ABC2D2E25F28 -48.46 6.94 -9.03 -0.88 0
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32094 4266047 2 ON2H7C8 AB2C7D8 73.0 4.52 -8.61 -0.85 0
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32095 4266048 1 O2S2N3C23H31 A2B2C3D23E31 -77.42 3.68 -8.68 -1.1 0
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32096 4266050 1 NS2O5C17H19 AB2C5D17E19 -196.09 5.39 -8.59 -0.99 0
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32097 4266051 1 OF2Cl3N3H8C13 AB2C3D3E8F13 -69.55 4.53 -8.81 -1.17 0
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32098 4266053 1 FN3O4C30H34 AB3C4D30E34 -169.16 5.03 -8.55 -0.2 0
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32099 4266054 1 BrN2O6C27H31 AB2C6D27E31 -161.78 6.4 -8.41 -0.41 0
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32100 4266058 1 ClON4H19C21 ABC4D19E21 65.5 1.18 -8.7 -0.91 0
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32101 4266060 1 SN2O5H18C21 AB2C5D18E21 -73.08 2.3 -8.3 -0.67 0
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32102 4266061 1 SO3F4N5H9C12 AB3C4D5E9F12 -172.09 5.71 -9.74 -1.96 0
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32103 4266069 1 BrN2O2C18H23 AB2C2D18E23 -38.1 4.93 -9.15 -0.37 0
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32104 4266070 1 ClN3O7H20C32 AB3C7D20E32 -68.23 6.24 -9.36 -2.2 0
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32105 4266071 1 ClN3O5H18C25 AB3C5D18E25 -105.41 2.08 -9.63 -1.82 0
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32106 4266073 1 FN3O3C22H26 AB3C3D22E26 -165.28 7.77 -8.76 -1.25 0
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32107 4266075 1 Cl2S2N3O3C17H19 A2B2C3D3E17F19 -81.15 7.72 -9.03 -1.14 0
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32108 4266089 1 SBr2O2N4H12C18 AB2C2D4E12F18 114.21 3.71 -9.54 -1.32 0
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32109 4266090 1 BrClON3H19C20 ABCD3E19F20 41.25 6.37 -8.61 -0.58 0
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32110 4266094 1 ClO2C21H29 AB2C21D29 -127.73 5.28 -9.97 -0.19 0
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32111 4266095 1 NO2C22H31 AB2C22D31 -107.54 5.54 -9.98 0.09 0
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32112 4266096 1 OCl2N7C20H25 AB2C7D20E25 24.53 5.96 -8.7 -0.92 0
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32113 4266097 1 SN4O4H14C20 AB4C4D14E20 56.2 8.32 -8.87 -1.65 0
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32114 4266098 1 FOSN3H16C22 ABCD3E16F22 39.83 1.1 -8.8 -0.98 0
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32115 4266115 1 O2N3C23H25 A2B3C23D25 -25.98 5.3 -8.5 -0.12 0
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32116 4266149 3 NOC7H7 ABC7D7 -5.95 9.07 -8.45 -0.82 0
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32117 4266150 1 ClON2C23H23 ABC2D23E23 3.87 4.93 -8.55 -0.41 0
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32118 4266152 1 FBr2N4O4H25C35 AB2C4D4E25F35 -63.85 2.82 -9.3 -0.83 0
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32119 4266154 1 NSO2Cl3H12C22 ABC2D3E12F22 -8.71 3.06 -9.1 -1.55 0
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32120 4266155 1 SO4N5C22H23 AB4C5D22E23 -89.2 2.32 -9.26 -0.87 0
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32121 4266156 1 Cl2O2N3C28H31 A2B2C3D28E31 -36.62 6.32 -8.31 -0.4 1
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32122 4266159 1 O2H19C24 A2B19C24 26.47 2.03 0.0 0.0 0
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32123 4266162 1 N3O3C12H13 A3B3C12D13 -54.51 4.67 -9.67 -0.99 0
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32124 4266168 1 BrN2O5H15C21 AB2C5D15E21 -103.99 3.59 -9.17 -1.59 0
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32125 4266207 3 NOSH7C8 ABCD7E8 8.3 7.56 -8.48 -1.24 0