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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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35050 7979234 1 SN3O6C19H21 AB3C6D19E21 -173.69 5.86 -9.3 -0.71 0
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35051 7979235 1 SN2O4C19H22 AB2C4D19E22 -133.41 6.45 -9.4 -0.57 0
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35052 7979236 1 Cl2N2O2H14C17 A2B2C2D14E17 -21.74 3.21 -9.41 -1.12 0
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35053 7979237 1 ClSN3O3C20H22 ABC3D3E20F22 -79.02 1.56 -8.79 -0.58 0
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35054 7979238 1 SN3O4C21H23 AB3C4D21E23 -99.36 5.71 -9.14 -0.28 0
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35055 7979239 1 SN3O4C21H23 AB3C4D21E23 -100.55 3.96 -9.34 -0.5 0
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35056 7979241 1 SN3O4C21H23 AB3C4D21E23 -103.06 5.83 -9.43 -0.62 0
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35057 7979242 1 SN3O4C21H25 AB3C4D21E25 -105.84 4.91 -8.73 -0.39 0
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35058 7979243 1 N3O3C22H27 A3B3C22D27 -93.13 3.04 -9.62 -0.3 0
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35059 7979244 1 NSO5H21C22 ABC5D21E22 -146.17 2.33 -9.06 -0.6 0
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35060 7979246 1 NSO5H21C22 ABC5D21E22 -145.84 3.39 -9.04 -0.43 0
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35061 7979247 1 NSO5H21C22 ABC5D21E22 -147.06 3.56 -8.99 -0.62 0
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35062 7979248 1 N2O3C18H18 A2B3C18D18 -62.72 3.84 -9.16 -0.48 0
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35063 7979251 1 SN2O2C17H18 AB2C2D17E18 -26.57 4.06 -8.84 -0.43 0
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35064 7979254 1 FNSO4H20C22 ABCD4E20F22 -159.15 4.33 -9.23 -0.57 0
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35065 7979261 1 NSO4C21H21 ABC4D21E21 -119.34 4.5 -8.95 -0.18 0
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35066 7979262 1 SO3N4C15H18 AB3C4D15E18 -74.68 8.6 -9.44 -0.8 0
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35067 7979263 1 SO3N4C15H18 AB3C4D15E18 -74.26 8.68 -9.43 -0.81 0
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35068 7979267 1 SN2O3H14C19 AB2C3D14E19 -10.74 1.35 -8.78 -0.92 0
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35069 7979269 1 NSO3C20H25 ABC3D20E25 -128.5 3.1 -9.09 -0.24 0
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35070 7979270 1 O2S2N3H11C15 A2B2C3D11E15 38.08 0.53 -9.3 -1.5 0
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35071 7979271 1 NSO3C20H25 ABC3D20E25 -128.36 2.56 -9.12 -0.24 0
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35072 7979273 1 NSO3C21H21 ABC3D21E21 -88.3 1.58 -9.07 -0.2 0
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35073 7979275 1 SF2N3O4H13C15 AB2C3D4E13F15 -197.45 2.75 -9.58 -1.03 0
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35074 7979276 1 NSO3C21H21 ABC3D21E21 -85.59 2.48 -9.14 -0.31 0
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35075 7979277 1 N2O2S3H14C15 A2B2C3D14E15 2.28 1.5 -9.0 -1.03 0
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35076 7979278 1 FNSO3H18C20 ABCD3E18F20 -121.55 3.86 -9.18 -0.35 0
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35077 7979279 1 SN3O3C12H17 AB3C3D12E17 -98.23 4.24 -9.46 -1.0 0
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35078 7979280 1 FNSO3H18C20 ABCD3E18F20 -123.78 4.58 -9.31 -0.39 0
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35079 7979281 1 FNSO3H18C20 ABCD3E18F20 -124.55 3.12 -9.22 -0.32 0
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35080 7979282 1 S2N3O3C17H19 A2B3C3D17E19 -66.98 5.19 -8.44 -1.14 0
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35081 7979283 1 FNSO3H18C20 ABCD3E18F20 -121.75 4.08 -9.24 -0.4 0
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35082 7979285 1 ClSN2O4C17H19 ABC2D4E17F19 -102.05 4.36 -8.82 -0.99 0
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35083 7979286 1 SN2O3H18C21 AB2C3D18E21 -46.96 3.2 -9.23 -0.94 0
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35084 7979288 1 FS2N3O4C16H18 AB2C3D4E16F18 -140.94 2.81 -9.55 -1.11 0
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35085 7979289 1 SN2O3H18C21 AB2C3D18E21 -45.04 4.86 -9.36 -0.81 0
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35086 7979290 1 ClSN3O3H12C14 ABC3D3E12F14 -55.23 1.97 -9.42 -0.84 0
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35087 7979291 1 SN2O3H18C21 AB2C3D18E21 -43.92 4.56 -9.27 -0.92 0
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35088 7979292 1 SN2O3C16H18 AB2C3D16E18 -70.24 1.73 -8.7 -0.98 0
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35089 7979293 1 ClNSO3H18C20 ABCD3E18F20 -86.71 3.75 -9.29 -0.39 0
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35090 7979294 1 BrSN3O4H10C12 ABC3D4E10F12 -67.9 1.23 -9.49 -0.99 0
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35091 7979295 1 ClNSO3H18C20 ABCD3E18F20 -88.28 3.64 -9.19 -0.41 0
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35092 7979296 1 SN3O4C18H21 AB3C4D18E21 -107.31 3.84 -9.12 -1.07 0
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35093 7979297 1 ClNSO3H18C20 ABCD3E18F20 -84.83 3.39 -9.21 -0.44 1
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35094 7979298 1 SN3O3C17H28 AB3C3D17E28 -101.99 9.51 0.0 0.0 0
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35095 7979299 1 SN3O4C16H19 AB3C4D16E19 -134.34 2.26 -9.52 -1.04 1
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35096 7979300 1 N2O3C20H33 A2B3C20D33 -117.14 3.31 0.0 0.0 0
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35097 7979301 1 N2O3C20H32 A2B3C20D32 -124.37 2.99 -8.36 0.17 0
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35098 7979302 1 SN3O4C16H19 AB3C4D16E19 -134.22 2.45 -9.52 -0.98 0
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35099 7979303 1 SN2O5H18C20 AB2C5D18E20 -83.4 4.6 -9.31 -1.51 1
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35100 7979304 1 N2O3C20H33 A2B3C20D33 -119.08 5.71 0.0 0.0 0
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35101 7979305 1 N2O3C20H32 A2B3C20D32 -123.93 2.97 -8.34 0.1 0
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35102 7979306 1 SN2O5H18C20 AB2C5D18E20 -82.9 4.71 -9.29 -1.54 0
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35103 7979317 1 SN2O3H14C15 AB2C3D14E15 -64.86 4.01 -9.34 -0.42 0
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35104 7979318 1 SN2O4H18C20 AB2C4D18E20 -51.91 2.75 -8.77 -1.01 0
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35105 7979319 1 SN2O3H14C15 AB2C3D14E15 -64.96 3.98 -9.33 -0.42 0
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35106 7979320 1 N2S2O3H12C13 A2B2C3D12E13 -43.65 3.57 -9.38 -1.1 0
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35107 7979321 1 SN2O3H14C15 AB2C3D14E15 -65.36 5.7 -9.32 -0.5 0
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35108 7979322 1 SO2N3H11C15 AB2C3D11E15 26.58 1.77 -9.46 -1.23 0
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35109 7979323 1 NSO5H21C22 ABC5D21E22 -159.61 5.02 -9.25 -0.78 0
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35110 7979324 1 SN2O2F3H9C13 AB2C2D3E9F13 -163.91 4.45 -9.64 -1.15 0
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35111 7979326 1 ClNO3C17H18 ABC3D17E18 -93.4 5.61 -8.46 -0.24 0
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35112 7979332 1 NSO4C16H17 ABC4D16E17 -139.91 2.41 -9.12 -0.31 0
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35113 7979334 1 NSO4C16H17 ABC4D16E17 -140.24 3.18 -9.12 -0.32 0
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35114 7979335 1 ClS2N3O4C16H18 AB2C3D4E16F18 -99.03 5.19 -9.5 -1.21 0
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35115 7979336 1 NSO4C16H17 ABC4D16E17 -142.16 2.01 -9.05 -0.16 1
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35116 7979337 1 NO2C23H32 AB2C23D32 -43.31 1.39 0.0 0.0 1
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35117 7979339 1 NO3C22H30 AB3C22D30 -81.09 3.36 0.0 0.0 0
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35118 7979340 1 NO3C22H29 AB3C22D29 -105.8 0.92 -8.88 0.11 0
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35119 7979341 1 ClNSO3H18C20 ABCD3E18F20 -88.11 3.65 -9.15 -0.4 0
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35120 7979342 1 ClN2O2S2H13C17 AB2C2D2E13F17 10.83 2.32 -8.89 -1.19 0
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35121 7979343 1 ClNSO3H18C20 ABCD3E18F20 -88.15 2.95 -9.13 -0.47 0
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35122 7979344 1 SO2N3H9C13 AB2C3D9E13 31.05 4.64 -9.63 -1.32 0
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35123 7979347 1 NO2C23H31 AB2C23D31 -64.53 2.16 -8.62 0.1 1
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35124 7979348 1 NO3C22H30 AB3C22D30 -79.54 1.38 0.0 0.0 1
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35125 7979350 1 NO2C23H32 AB2C23D32 -42.96 1.54 0.0 0.0 0
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35126 7979351 1 NO2C23H31 AB2C23D31 -61.02 3.06 -8.68 0.07 1
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35127 7979352 1 NO3C22H30 AB3C22D30 -80.68 3.35 0.0 0.0 0
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35128 7979354 1 SN2O2C12H16 AB2C2D12E16 -52.11 0.48 -9.1 -0.98 0
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35129 7979357 1 ClNSO3H18C20 ABCD3E18F20 -86.57 1.68 -9.19 -0.43 0
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35130 7979362 2 NOSC7H7 ABCD7E7 -13.57 2.49 -9.02 -0.97 0
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35131 7979363 1 NSO5C17H17 ABC5D17E17 -179.63 6.99 -9.29 -0.45 0
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35132 7979364 1 SN2O2F3H11C15 AB2C2D3E11F15 -150.87 3.86 -9.11 -1.27 0
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35133 7979365 1 NF3O5H18C20 AB3C5D18E20 -301.25 7.82 -8.88 -1.08 0
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35134 7979366 1 NSO4C19H23 ABC4D19E23 -156.11 3.98 -9.06 -0.23 0
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35135 7979368 1 N3O5C19H21 A3B5C19D21 -113.11 5.93 -8.54 -0.3 0
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35136 7979369 1 SN2O2C11H12 AB2C2D11E12 -10.16 1.84 -9.32 -0.96 0
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35137 7979370 1 NSO4C19H23 ABC4D19E23 -151.94 2.7 -9.0 -0.18 0
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35138 7979371 1 SN2O4C16H16 AB2C4D16E16 -74.31 5.33 -8.8 -0.81 0
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35139 7979373 1 N3O4H21C22 A3B4C21D22 -58.56 9.13 -8.82 -0.72 0
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35140 7979374 1 SN2O3H14C15 AB2C3D14E15 -30.39 2.09 -9.12 -1.02 0
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35141 7979376 1 N3O5C16H17 A3B5C16D17 -105.97 4.01 -9.14 -0.79 0
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35142 7979377 1 ClNSO4H18C21 ABCD4E18F21 -112.42 2.94 -9.12 -1.0 0
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35143 7979378 1 ClNSO4H18C21 ABCD4E18F21 -114.94 4.11 -9.22 -0.93 0
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35144 7979380 1 SN2O2C14H18 AB2C2D14E18 -41.61 0.53 -9.01 -0.96 0
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35145 7979381 1 ClNSO4H18C21 ABCD4E18F21 -112.78 3.45 -9.22 -0.99 0
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35146 7979382 1 SN2O2C14H18 AB2C2D14E18 -42.34 1.53 -9.53 -1.04 0
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35147 7979385 1 SN2O4C22H22 AB2C4D22E22 -110.23 1.98 -9.09 -0.28 0
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35148 7979387 1 SN2O4C22H22 AB2C4D22E22 -108.79 3.65 -8.94 -0.32 0
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35149 7979388 1 S2N3O4C18H23 A2B3C4D18E23 -113.21 5.15 -9.24 -0.77 0