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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175214 75868056 1 N3O5C25H33 A3B5C25D33 -148.05 3.04 -8.68 -0.74 1
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175215 75868057 1 SN3O3C25H32 AB3C3D25E32 -23.44 13.14 0.0 0.0 0
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175216 75868212 4 OC5H7 AB5C7 -155.4 2.26 -8.31 0.19 0
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175217 75868227 1 O2N4C23H28 A2B4C23D28 -19.26 7.73 -7.98 -0.72 0
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175218 75868228 1 NO3C21H27 AB3C21D27 -91.14 3.23 -8.62 0.02 1
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175219 75868229 1 N4O4C20H31 A4B4C20D31 -167.53 2.64 0.0 0.0 0
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175220 75868230 1 ClSN3O3H14C18 ABC3D3E14F18 -56.41 5.06 -8.88 -0.83 -1
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175221 75868282 1 SN4O4H19C22 AB4C4D19E22 -28.67 5.6 0.0 0.0 0
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175222 75869084 1 O3N4C15H16 A3B4C15D16 -8.51 4.13 -8.89 -1.56 0
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175223 75869437 1 SCl2O2N5H11C17 AB2C2D5E11F17 36.7 8.45 -8.98 -1.27 0
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175224 75869757 1 BrOSN2C19H19 ABCD2E19F19 25.79 1.97 -8.82 -0.57 0
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175225 75869758 1 ClN4O4H15C17 AB4C4D15E17 -51.92 5.59 -9.07 -1.04 0
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175226 75869922 1 NSO2C16H19 ABC2D16E19 -41.54 3.46 -8.64 -0.56 0
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175227 75871056 1 N3O4H23C26 A3B4C23D26 -82.82 2.64 -8.71 -0.64 0
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175228 75871057 1 ClN3O4C22H22 AB3C4D22E22 -132.84 5.67 -8.6 -0.33 0
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175229 75871058 1 SN2O4H22C23 AB2C4D22E23 -60.74 3.81 -9.29 -1.12 0
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175230 75871321 2 NOC8H11 ABC8D11 -58.02 4.98 -8.53 0.24 0
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175231 75871339 1 NSO4C19H23 ABC4D19E23 -112.4 3.76 -8.59 -0.57 0
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175232 75871661 1 ClN2O6H19C21 AB2C6D19E21 -216.72 7.19 -9.03 -1.62 0
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175233 75871662 1 N4O5C26H26 A4B5C26D26 -81.77 3.25 -8.67 -1.11 0
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175234 75871663 1 O3N6C22H24 A3B6C22D24 -29.6 6.1 -8.92 -1.21 0
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175235 75871947 1 NSO2C17H21 ABC2D17E21 -44.42 3.96 -8.97 -0.27 0
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175236 75871948 1 SN2O3C18H22 AB2C3D18E22 -80.4 5.53 -8.88 -0.87 0
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175237 75871949 1 N2O4C19H24 A2B4C19D24 -120.37 3.38 -8.93 -0.33 0
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175238 75871950 1 O2N3C21H23 A2B3C21D23 2.78 2.33 -9.26 -0.58 0