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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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190319 77984478 1 N3O5C31H35 A3B5C31D35 -150.17 4.29 -8.87 -0.08 0
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190320 77985125 1 IOC12H13 ABC12D13 -0.63 3.56 -9.47 -1.05 0
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190321 77985126 1 IOC14H17 ABC14D17 -10.2 3.58 -9.46 -1.05 0
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190322 77985127 1 SiO2C18H32 AB2C18D32 -130.58 3.17 -8.6 0.88 0
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190323 77985128 1 SiO2C19H32 AB2C19D32 -107.31 1.53 -8.76 0.83 0
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190324 77985616 1 FN2O10C32H35 AB2C10D32E35 -414.68 4.25 -8.78 -0.61 0
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190325 77985617 1 O3N10C31H48 A3B10C31D48 -93.46 5.56 -9.1 -0.01 0
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190326 77985747 1 NO8C24H27 AB8C24D27 -303.3 5.15 -8.84 -1.07 0
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190327 77985930 1 FPO7N8C23H30 ABC7D8E23F30 -335.94 7.21 -8.69 -0.61 0
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190328 77985931 1 PN7O9C21H26 AB7C9D21E26 -363.3 3.73 -9.01 -0.95 0
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190329 77985932 1 FPN7O8C21H25 ABC7D8E21F25 -365.03 6.55 -8.49 -1.0 0
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190330 77985933 1 PN8O8C21H27 AB8C8D21E27 -316.56 4.98 -8.8 -0.83 0
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190331 77986709 1 ClN2O2C7H9 AB2C2D7E9 -80.18 3.14 -10.62 -0.42 0
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190332 77988041 1 Si2O3C25H52 A2B3C25D52 -320.09 1.79 -8.7 1.26 0
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190333 77988042 1 ClON8C27H33 ABC8D27E33 95.37 10.72 -8.31 -0.75 0
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190334 77988413 1 FN4O4H25C27 AB4C4D25E27 -104.77 6.57 -8.33 -1.36 0
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190335 77988604 1 NO5H21C22 AB5C21D22 -62.46 6.58 -9.31 -1.64 0
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190336 77989050 2 NOC8H9 ABC8D9 -48.94 3.28 -9.54 0.0 0
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190337 77989204 1 NOH17C18 ABC17D18 40.99 2.3 -8.61 -0.16 0
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190338 77989623 1 S2N3O6C9H15 A2B3C6D9E15 -263.6 6.6 -9.75 -0.93 0
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190339 77989624 1 S2N4O7C15H26 A2B4C7D15E26 -337.0 6.91 -9.18 -1.47 0
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190340 77989895 1 FN2O3C19H21 AB2C3D19E21 -116.92 3.84 -9.36 -0.34 0
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190341 77989897 1 ON3F7H16C22 AB3C7D16E22 -326.67 5.53 -9.95 -0.99 0
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190342 77990106 1 FSN6O6C33H39 ABC6D6E33F39 -207.06 6.26 -9.44 -0.83 0
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190343 77990107 1 SN6O6C31H36 AB6C6D31E36 -142.9 8.01 -9.73 -1.05 0
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190344 77990108 1 SO4N7C19H27 AB4C7D19E27 -67.68 6.66 -8.2 -1.9 0
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190345 77990175 1 N2P2O10C15H34 A2B2C10D15E34 -555.73 11.74 -9.17 -0.18 2
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190346 77990176 1 N2P2O10C15H36 A2B2C10D15E36 -531.36 16.96 -6.82 -0.42 0
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190347 77990177 1 NO4C17H29 AB4C17D29 -175.2 3.74 -9.31 0.83 0
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190348 77990434 1 O5C30H48 A5B30C48 -249.14 3.96 -8.33 0.5 0
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190349 77990435 1 O5C30H46 A5B30C46 -234.74 4.3 -8.4 0.43 0
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190350 77990436 1 O5C30H48 A5B30C48 -253.44 6.93 -9.79 0.54 0
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190351 77990437 1 N3S4O5C24H25 A3B4C5D24E25 -102.93 5.79 -8.89 -1.14 0
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190352 77990438 1 O5C14H14 A5B14C14 -161.54 1.42 -9.27 -1.1 0
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190353 77990545 1 ClFO2N5H21C22 ABC2D5E21F22 -24.57 10.27 -8.52 -1.0 1
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190354 77990546 1 SN2O7H17C20 AB2C7D17E20 -48.14 3.92 0.0 0.0 0
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190355 77990547 1 Br2N2S2O7H22C24 A2B2C2D7E22F24 -143.7 7.51 -9.01 -1.26 0
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190356 77990548 1 NBr2S2O5H23C24 AB2C2D5E23F24 -151.02 4.72 -8.84 -0.66 0
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190357 77990676 1 NO7H17C21 AB7C17D21 -221.12 3.15 -9.32 -1.92 0
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190358 77991630 1 FNO2C12H14 ABC2D12E14 -74.81 2.17 -9.57 -0.55 0
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190359 77991659 1 BrN2O4H19C20 AB2C4D19E20 -12.6 5.6 -8.79 -0.32 0
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190360 77991861 1 ON2C22H24 AB2C22D24 27.25 4.7 -8.09 -0.04 0
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190361 77991862 1 O5H18C22 A5B18C22 -134.33 1.84 -10.02 -0.94 0
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190362 77992237 1 N4O4C39H44 A4B4C39D44 -104.29 4.41 -9.39 -0.41 0
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190363 77992238 2 N2O2C20H23 A2B2C20D23 -109.26 8.17 -9.29 -0.63 0
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190364 77992430 1 ClNSO6C37H46 ABCD6E37F46 -192.01 5.77 -9.43 -0.87 0
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190365 77992431 1 BrNO2H12C15 ABC2D12E15 5.2 2.16 -8.74 -0.62 0
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190366 77992825 1 ClN2O4C17H23 AB2C4D17E23 -168.63 2.08 -9.44 -0.54 0
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190367 77992826 1 N3O4C18H23 A3B4C18D23 -130.11 6.44 -9.73 -0.78 0
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190368 77992827 2 NO2C9H13 AB2C9D13 -174.94 6.34 -9.24 -0.16 0