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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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340130 127262139 1 N5O5C29H31 A5B5C29D31 -66.13 8.66 -9.37 -1.44 0
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340131 127262140 1 N5O5C23H29 A5B5C23D29 -104.7 7.47 -9.43 -1.33 0
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340132 127262141 1 N5O5C22H27 A5B5C22D27 -98.58 6.73 -9.51 -1.33 0
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340133 127262142 6 NOC4H5 ABC4D5 -143.51 7.61 -9.74 -1.44 0
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340134 127262143 2 N3O3C13H16 A3B3C13D16 -137.36 4.73 -9.74 -1.98 0
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340135 127262144 1 N7O7C32H43 A7B7C32D43 -212.73 8.98 -9.32 -1.3 0
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340136 127262145 1 N5O5C23H27 A5B5C23D27 -96.65 12.26 -9.7 -1.19 0
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340137 127262146 1 ClO3N4C19H29 AB3C4D19E29 -126.77 5.36 -9.54 0.16 0
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340138 127262147 1 ClO3N4C19H29 AB3C4D19E29 -127.94 4.76 -9.21 -0.44 0
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340139 127262148 1 N6O6C25H30 A6B6C25D30 -130.83 4.9 -9.39 -1.3 0
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340140 127262149 1 IO3N4C25H33 AB3C4D25E33 -91.67 2.79 -9.27 -0.79 0
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340141 127262150 1 IO3N4C25H33 AB3C4D25E33 -68.0 3.45 -9.18 -0.62 0
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340142 127262151 1 IO3N4C25H33 AB3C4D25E33 -98.38 4.87 -9.33 -0.86 0
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340143 127262152 1 IO3N4C25H33 AB3C4D25E33 -97.67 6.42 -9.16 -0.85 0
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340144 127262153 1 IO3N4C25H33 AB3C4D25E33 -101.7 5.26 -9.24 -0.8 0
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340145 127262154 1 IO3N4C25H33 AB3C4D25E33 -100.88 6.44 -9.17 -0.68 0
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340146 127262155 1 FN4O5C20H23 AB4C5D20E23 -145.65 6.64 -9.73 -1.48 0
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340147 127262156 1 O5N6C34H38 A5B6C34D38 -132.7 4.57 -8.53 -0.51 0
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340148 127262157 1 O5N6C34H38 A5B6C34D38 -134.67 4.52 -8.66 -0.3 0
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340149 127262158 5 NOC6H7 ABC6D7 -162.11 5.42 -9.18 -0.21 0
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340150 127262159 1 SN5O8C28H39 AB5C8D28E39 -321.3 3.94 -8.97 -0.43 0
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340151 127262160 1 N5O6C25H33 A5B6C25D33 -233.71 3.88 -9.11 -0.11 0
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340152 127262161 3 N2O2C9H12 A2B2C9D12 -242.43 9.72 -9.24 -0.23 0
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340153 127262162 1 N5O5C35H53 A5B5C35D53 -240.82 6.97 -9.12 -0.1 0
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340154 127262163 1 S2N5O8C30H43 A2B5C8D30E43 -324.07 9.07 -8.74 -0.46 0
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340155 127262164 1 S2N5O8C30H43 A2B5C8D30E43 -329.61 5.6 -8.58 -0.3 0
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340156 127262165 1 SN5O7C31H43 AB5C7D31E43 -284.55 8.63 -8.74 -0.3 0
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340157 127262166 1 N4O4C33H38 A4B4C33D38 -79.31 5.13 -9.05 -0.05 0
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340158 127262167 1 N5O7C28H37 A5B7C28D37 -283.19 5.16 -9.19 -0.2 0
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340159 127262168 2 N3O3C14H19 A3B3C14D19 -242.47 4.4 -9.12 -0.08 0
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340160 127262169 1 PN5O8C23H30 AB5C8D23E30 -369.23 5.74 -9.22 -0.25 0
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340161 127262170 1 SN5O5C26H35 AB5C5D26E35 -179.09 9.18 -8.36 -0.35 0
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340162 127262171 2 N3O3C13H13 A3B3C13D13 -106.29 9.13 -8.96 -1.52 0
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340163 127262172 1 N4O4C23H34 A4B4C23D34 -180.47 10.72 -9.19 -0.35 0
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340164 127262173 1 N4O4C19H28 A4B4C19D28 -147.55 0.83 -9.4 0.0 0
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340165 127262174 1 SN5O6C27H35 AB5C6D27E35 -150.82 7.53 -9.28 -1.33 0
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340166 127262175 1 N5O5C28H39 A5B5C28D39 -193.26 3.52 -8.85 -0.17 0
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340167 127262176 1 ClO3N4C22H35 AB3C4D22E35 -136.93 1.86 -9.46 -0.41 0
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340168 127262177 1 ClN5O6C30H40 AB5C6D30E40 -246.53 6.94 -8.92 -0.67 0
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340169 127262178 1 ClO3N4C21H33 AB3C4D21E33 -134.77 5.28 -9.27 -0.15 0
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340170 127262179 1 N4O5C29H40 A4B5C29D40 -197.76 6.22 -9.36 -0.08 0
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340171 127262180 1 N5O5C23H33 A5B5C23D33 -220.68 7.65 -9.11 0.32 0
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340172 127262181 1 N2O3C11H24 A2B3C11D24 -150.81 1.05 -9.91 0.69 0
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340173 127262182 1 NO2C12H15 AB2C12D15 -58.87 2.17 -9.01 0.31 0
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340174 127262183 1 NO2C11H21 AB2C11D21 -116.27 2.56 -9.32 0.92 0
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340175 127262184 1 N3O3C19H25 A3B3C19D25 -71.07 6.21 -9.01 0.14 0
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340176 127262185 3 NOC6H9 ABC6D9 -124.74 4.2 -8.93 -0.03 0
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340177 127262186 1 N3O3C16H23 A3B3C16D23 -114.89 5.97 -8.93 0.24 0
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340178 127262187 3 NOC5H7 ABC5D7 -104.34 6.47 -8.94 0.19 0
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340179 127262188 1 ClN2O2C21H29 AB2C2D21E29 -85.82 1.87 -8.82 -0.29 0