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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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151386 53801176 1 SN6C16H26 AB6C16D26 64.75 5.22 -8.36 -0.68 0
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151387 53801178 1 ClFO2C26H26 ABC2D26E26 -64.89 3.23 -8.91 -0.19 0
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151388 53801179 1 ClSN2O2H9C12 ABC2D2E9F12 -29.71 9.07 -9.32 -0.96 0
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151389 53801180 1 ON4H14C16 AB4C14D16 219.74 5.11 -8.6 -1.09 0
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151390 53801183 1 FO4C19H27 AB4C19D27 -247.49 3.46 -9.19 -0.1 0
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151391 53801184 1 O4C11H16 A4B11C16 -174.29 2.25 -10.5 -0.81 1
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151392 53801186 1 N3O4C12H16 A3B4C12D16 -111.83 5.82 0.0 0.0 0
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151393 53801187 1 ON2Br3H7C9 AB2C3D7E9 23.2 5.06 -9.77 -1.42 0
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151394 53801188 1 OSN2C14H22 ABC2D14E22 -36.61 5.79 -9.25 -0.82 0
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151395 53801189 1 NSO7C17H21 ABC7D17E21 -266.77 7.54 -8.41 -0.66 0
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151396 53801190 1 FNSO2H10C15 ABCD2E10F15 -45.08 1.62 -8.41 -0.69 0
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151397 53801191 1 NO4C13H15 AB4C13D15 -142.25 6.96 -8.21 -0.57 0
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151398 53801192 1 NO3C8H13 AB3C8D13 -140.48 2.47 -9.66 0.38 0
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151399 53801194 1 NOC11H21 ABC11D21 -88.61 3.99 -10.22 1.26 0
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151400 53801195 1 N5O5H21C23 A5B5C21D23 -72.98 5.92 -9.56 -0.91 0
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151401 53801196 1 N3O9C32H45 A3B9C32D45 -363.79 7.19 -9.93 -0.5 0
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151402 53801208 4 C3H5 A3B5 -9.97 0.36 -8.74 1.55 0
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151403 53801210 3 OC9H14 AB9C14 -192.96 4.25 -9.33 0.76 0
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151404 53801211 1 SiO6C40H62 AB6C40D62 -363.79 2.0 -9.36 -0.78 0
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151405 53801212 1 O2H16C17 A2B16C17 -53.28 4.65 -9.03 -0.71 0
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151406 53801213 1 OF2N2H26C27 AB2C2D26E27 -58.77 3.64 -8.93 -0.88 0
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151407 53801214 1 O2F8N8H30C33 A2B8C8D30E33 -325.81 5.99 -8.93 -1.3 0
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151408 53801215 1 SN3O7C17H19 AB3C7D17E19 -160.57 5.04 -9.99 -1.35 0
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151409 53801217 1 O2C9H14 A2B9C14 -90.1 6.44 -9.99 -0.08 0
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151410 53801219 2 O2C17H26 A2B17C26 -186.93 3.68 -8.68 0.12 0
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151411 53801223 1 BrOC9H19 ABC9D19 -85.75 3.38 -9.79 0.08 0
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151412 53801225 1 BrPSO2Cl3C12H15 ABCD2E3F12G15 -156.44 4.03 -9.52 -0.9 0
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151413 53801226 2 O2C11H11 A2B11C11 -77.65 0.72 -8.28 0.25 0
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151414 53801227 1 NO10C36H53 AB10C36D53 -404.01 6.4 -8.98 -1.18 0
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151415 53801230 1 NPO3C14H14 ABC3D14E14 -125.24 0.9 -9.61 -0.11 0
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151416 53801231 2 NC13H17 AB13C17 46.62 0.38 -8.72 -0.73 0
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151418 53801236 1 N2O5C14H18 A2B5C14D18 -156.69 2.63 -9.62 -0.93 0
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151419 53801237 2 NO4C6H6 AB4C6D6 -156.02 6.87 -10.48 -1.64 0
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151420 53801238 1 O9C11H14 A9B11C14 -348.56 3.79 -10.32 -0.66 0
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151421 53801241 1 FNCl2O2C3H4 ABC2D2E3F4 -112.38 1.78 -10.67 -1.02 0
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151422 53801242 1 SCl2O3N4C21H24 AB2C3D4E21F24 -81.55 4.57 -8.74 -1.28 0
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151423 53801247 2 NC9H14 AB9C14 1.93 6.03 -8.69 0.78 0
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151424 53801252 1 SO2N4C14H22 AB2C4D14E22 -44.42 0.57 -9.81 -1.37 0
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151425 53801258 2 NO2C11H13 AB2C11D13 -115.68 6.14 -9.34 -0.24 0
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151426 53801260 1 N2O2H36C39 A2B2C36D39 53.21 6.64 -8.74 -0.91 0
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151427 53801262 1 OF3C7H13 AB3C7D13 -243.14 3.57 -11.42 0.4 0
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151428 53801263 2 IC3F6 AB3C6 -557.55 2.09 -10.92 -2.85 0
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151429 53801265 1 SN2O3C22H26 AB2C3D22E26 -96.04 2.43 -8.5 -0.23 0
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151430 53801267 1 ClNOSC4H4 ABCDE4F4 -9.38 2.13 -8.97 -0.7 0
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151431 53801268 1 N2S2O7C16H16 A2B2C7D16E16 -237.39 2.5 -9.42 -0.88 0
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151432 53801269 1 NO3C25H35 AB3C25D35 -80.6 2.28 -8.13 0.28 0
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151433 53801270 1 NO3C25H35 AB3C25D35 -78.35 0.73 -8.14 0.41 0
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151434 53801271 1 SN3O8H29C34 AB3C8D29E34 -199.32 4.32 -9.53 -1.1 0
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151435 53801272 1 ClN3O3C22H34 AB3C3D22E34 -107.24 1.87 -8.8 -0.44 0
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151436 53801274 1 O2N7C25H29 A2B7C25D29 51.98 0.94 -9.48 -0.57 0