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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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85179 49872214 2 O3N4C20H21 A3B4C20D21 -135.06 5.68 -8.86 -0.42 0
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85180 49872227 1 O2N4H22C23 A2B4C22D23 66.47 2.85 -9.15 -0.85 0
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85181 49872232 1 ClNOC14H20 ABCD14E20 -47.12 2.95 -8.87 -0.16 0
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85182 49872235 1 O2N3C22H25 A2B3C22D25 -47.34 6.19 -8.79 -1.12 0
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85183 49872237 1 O2N3C23H27 A2B3C23D27 -52.57 7.48 -8.64 -1.1 0
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85184 49872242 1 FN7H14C20 AB7C14D20 102.62 3.93 -9.32 -1.21 0
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85185 49872245 1 FON8H21C24 ABC8D21E24 69.33 4.35 -8.95 -1.12 0
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85186 49872248 1 OF3N3H14C16 AB3C3D14E16 -130.73 8.33 -9.1 -0.68 0
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85187 49872249 1 OSN3C14H15 ABC3D14E15 12.93 4.92 -8.47 -0.37 0
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85188 49872250 1 O2N4H16C17 A2B4C16D17 26.82 4.4 -8.88 -0.75 0
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85189 49872251 1 ON4C15H16 AB4C15D16 15.3 3.65 -9.28 -0.52 0
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85190 49872254 1 ON5C17H17 AB5C17D17 55.17 6.16 -8.35 -0.37 0
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85191 49872255 1 ClON4H13C16 ABC4D13E16 40.72 7.29 -9.38 -0.99 0
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85192 49872256 1 NO2F3C29H38 AB2C3D29E38 -258.71 3.96 -8.75 -0.75 0
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85193 49872259 1 SN2O3F4C30H32 AB2C3D4E30F32 -285.82 0.99 -8.82 -0.45 0
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85194 49872265 1 N4O6C27H34 A4B6C27D34 -167.36 2.29 -9.27 -1.25 -2
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85196 49872292 1 NO3C22H31 AB3C22D31 -133.71 3.87 -9.35 0.22 0
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85197 49872312 1 N4O9C31H40 A4B9C31D40 -338.28 5.02 -8.78 -0.49 0
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85198 49872316 1 O6N8C43H48 A6B8C43D48 -166.63 9.48 -8.91 -0.62 0
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85199 49872319 1 O6N7C25H27 A6B7C25D27 -87.22 7.4 -9.3 -1.09 0
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85200 49872321 1 O6N7C22H27 A6B7C22D27 -102.92 4.72 -9.1 -0.89 0
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85201 49872322 1 O6N7C22H27 A6B7C22D27 -114.04 4.79 -9.17 -0.96 0
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85202 49872324 1 PN8O11C40H63 AB8C11D40E63 -571.91 2.52 -9.32 -0.23 0
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85203 49872325 1 PN8O12C36H55 AB8C12D36E55 -597.07 14.83 -9.25 -0.25 0
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85204 49872327 1 PN8O11C37H57 AB8C11D37E57 -565.82 5.66 -9.26 0.18 0