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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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259200 103158582 1 N2O4C13H24 A2B4C13D24 -214.87 3.75 -9.84 0.65 0
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259201 103158583 1 O3C17H24 A3B17C24 -138.86 3.47 -9.01 -0.47 0
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259202 103158588 1 BrO3C16H21 AB3C16D21 -125.84 5.83 -9.35 -0.82 0
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259203 103158591 1 N3O5C10H19 A3B5C10D19 -231.22 5.53 -9.71 0.34 0
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259204 103158592 1 O3C17H22 A3B17C22 -123.97 3.78 -9.15 -0.69 0
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259205 103158593 1 N3O5C11H21 A3B5C11D21 -227.66 6.44 -9.38 0.62 0
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259206 103158599 1 ClFN2O4C12H14 ABC2D4E12F14 -210.5 7.67 -9.52 -0.79 0
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259207 103158600 1 FO3C16H21 AB3C16D21 -175.16 4.32 -9.41 -0.85 0
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259208 103158601 2 NO3C6H10 AB3C6D10 -270.01 9.54 -9.97 0.26 0
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259209 103159498 1 ClO3C17H23 AB3C17D23 -155.33 4.17 -9.6 -0.36 0
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259210 103162090 1 NO6C12H19 AB6C12D19 -270.05 6.68 -9.93 -0.27 0
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259211 103162091 1 NO3C10H17 AB3C10D17 -150.06 6.28 -10.2 0.36 0
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259212 103162092 1 NO4C12H21 AB4C12D21 -195.26 5.0 -9.82 0.33 0
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259213 103162111 1 NO5C15H25 AB5C15D25 -236.98 2.1 -9.8 0.14 0
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259214 103162122 1 NO3C12H21 AB3C12D21 -158.0 6.53 -10.05 0.6 0
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259215 103162126 1 NO3C12H21 AB3C12D21 -161.56 3.19 -10.35 0.5 0
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259216 103162135 1 NCl2O3C13H13 AB2C3D13E13 -120.42 6.58 -9.76 -1.27 0
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259217 103162141 1 NSO3C11H17 ABC3D11E17 -132.6 6.38 -9.06 0.09 0
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259218 103162157 1 NO4C15H25 AB4C15D25 -195.44 5.98 -9.89 0.39 0
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259219 103162158 1 NO3C12H21 AB3C12D21 -156.77 1.71 -9.9 0.51 0
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259220 103162162 2 NO2C7H9 AB2C7D9 -149.44 1.44 -9.64 -1.28 0
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259221 103162163 1 NO4C13H15 AB4C13D15 -153.71 10.68 -9.41 -1.02 0
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259222 103162170 1 N3O3C12H17 A3B3C12D17 -107.44 4.71 -9.71 0.18 0
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259223 103162171 1 N3O4C14H21 A3B4C14D21 -154.1 5.96 -9.81 0.05 0
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259224 103162172 1 NO3C16H19 AB3C16D19 -109.84 3.39 -9.58 0.03 0