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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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168307 74950519 2 ON4C9H9 AB4C9D9 104.42 3.62 -8.21 -0.92 0
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168308 74950740 1 SN5O9C33H47 AB5C9D33E47 -382.78 3.04 -9.32 -1.1 0
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168309 74950857 1 NO13C54H103 AB13C54D103 -757.93 2.55 -9.79 0.44 0
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168310 74950913 2 N2O2H12C13 A2B2C12D13 -72.73 7.27 -8.57 -1.22 0
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168311 74951073 1 O5N6C27H42 A5B6C27D42 -162.35 19.63 -8.45 -0.66 0
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168312 74951130 1 O7C23H32 A7B23C32 -306.77 2.43 -9.7 0.03 0
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168313 74951131 1 O4C9H16 A4B9C16 -175.53 1.63 -9.92 0.46 0
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168314 74951132 1 O5C17H24 A5B17C24 -183.63 4.33 -8.86 0.15 0
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168315 74951138 1 BrSiO5C23H35 ABC5D23E35 -241.2 3.83 -8.69 -0.2 0
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168316 74951139 1 O7C24H26 A7B24C26 -219.04 1.32 -8.64 -0.42 0
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168317 74951140 1 NO6C19H25 AB6C19D25 -213.75 6.14 -8.93 -0.35 0
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168318 74951141 1 SiO3C23H32 AB3C23D32 -141.2 3.17 -8.91 0.09 0
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168319 74951142 1 SiO7C45H66 AB7C45D66 -336.13 4.82 -8.61 0.21 0
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168320 74951143 1 SSi2N4O7C60H82 AB2C4D7E60F82 -273.03 5.35 -8.99 -1.19 0
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168321 74951262 1 BrON5H20C25 ABC5D20E25 96.03 3.51 -8.55 -0.99 0
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168322 74951439 1 O3N6C33H38 A3B6C33D38 -15.46 7.43 -9.1 -1.03 0
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168323 74951505 1 NSO10C21H25 ABC10D21E25 -405.02 5.48 -9.03 -0.66 0
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168324 74951545 2 OC11H18 AB11C18 -98.16 5.49 -9.52 -0.35 0
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168325 74951546 2 OC12H23 AB12C23 -180.35 4.87 -9.68 0.6 0
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168326 74951693 1 N2O5C30H34 A2B5C30D34 -86.74 4.92 -8.68 -0.05 0
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168327 74952399 1 SN8O10C40H56 AB8C10D40E56 -418.29 8.91 -8.64 -0.15 0
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168328 74952446 2 O3N4C24H25 A3B4C24D25 -132.47 3.82 -8.35 -0.25 0
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168329 74952699 1 ClS2O8C35H35 AB2C8D35E35 -239.46 6.74 -9.33 -1.7 0
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168330 74952700 1 SF5O8C36H39 AB5C8D36E39 -545.15 5.21 -9.32 -1.72 0
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168331 74953155 1 SO9H26C31 AB9C26D31 -243.5 0.87 -8.38 -0.98 0
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168332 74953576 1 S2N9O10C42H77 A2B9C10D42E77 -572.33 8.15 -9.0 0.05 0
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168333 74953666 1 FSN3O4C30H32 ABC3D4E30F32 -92.56 4.09 -8.94 -1.1 0
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168334 74953667 1 FSN3O3C22H28 ABC3D3E22F28 -108.14 5.98 -8.76 -0.56 0
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168335 74953668 1 SO2F5N5H30C31 AB2C5D5E30F31 -200.7 3.5 -8.98 -0.71 0
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168336 74953948 1 O3N4C23H40 A3B4C23D40 -185.01 9.47 -8.41 1.2 0
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168337 74953959 1 ON5C27H33 AB5C27D33 2.07 2.65 -8.14 -0.52 0
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168338 74954045 1 OSCl2F3N3H12C17 ABC2D3E3F12G17 -135.75 7.11 -8.83 -1.12 0
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168339 74954046 1 Cl2S2F3N3H12C17 A2B2C3D3E12F17 -78.6 3.57 -8.82 -1.5 0
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168340 74954047 1 OSN3F4H13C17 ABC3D4E13F17 -169.44 7.74 -8.76 -0.94 0
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168341 74954394 1 ClO2S2N5C28H28 AB2C2D5E28F28 14.79 6.24 -8.78 -0.95 0
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168342 74954410 1 SO3N4C24H28 AB3C4D24E28 -59.82 2.95 -8.16 -0.55 0
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168343 74954411 1 FN3H24C26 AB3C24D26 43.26 4.63 -8.44 -0.54 0
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168344 74954504 1 SN3O4H17C20 AB3C4D17E20 -70.51 8.82 -9.06 -1.03 0
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168345 74955111 1 O5C22H24 A5B22C24 -130.5 2.77 -9.52 -0.81 0
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168346 74955231 1 ON2C18H28 AB2C18D28 -5.19 3.04 -8.99 0.32 0
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168347 74955412 1 NO2C15H27 AB2C15D27 -113.13 5.45 -9.74 0.64 0
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168348 74955660 1 NiN3O3H23C26 AB3C3D23E26 208.38 6.11 -7.68 -3.79 0
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168349 74956475 1 N4O35C73H96 A4B35C73D96 -1466.44 8.94 -8.13 -0.42 0
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168350 74956476 3 NO8C17H21 AB8C17D21 -1036.68 5.64 -8.92 -0.47 0
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168351 74956479 1 ClO6C24H29 AB6C24D29 -236.2 4.71 -8.64 -1.15 0
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168352 74956604 4 NOH6C7 ABC6D7 0.68 1.15 -8.57 -0.85 0
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168353 74956948 1 ClS2N4O5C28H31 AB2C4D5E28F31 -147.58 5.72 -9.02 -1.14 0
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168354 74957005 1 ClFS2N4O5C28H30 ABC2D4E5F28G30 -192.42 5.87 -9.07 -1.14 0
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168355 74957006 1 S3N4O5C26H30 A3B4C5D26E30 -131.68 6.11 -8.73 -0.99 0
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168356 74957233 1 N2O2C15H16 A2B2C15D16 -31.65 5.36 -9.94 -2.08 0
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168357 74957234 1 O2N3C15H21 A2B3C15D21 -23.44 4.43 -8.1 -0.42 0
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168358 74957235 1 O2N3C18H23 A2B3C18D23 -31.27 6.18 -8.68 -0.64 0
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168359 74957236 1 N2O3H12C17 A2B3C12D17 11.47 5.98 -9.27 -1.42 0
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168360 74957237 1 ON4H12C17 AB4C12D17 136.94 7.95 -9.15 -1.84 0
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168361 74957238 1 Cl2N2O3H12C14 A2B2C3D12E14 -42.02 3.61 -8.48 -1.45 0
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168362 74957239 1 O3C22H22 A3B22C22 -70.95 5.16 -9.65 -0.92 0
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168363 74957240 1 ClO2N3H8C15 AB2C3D8E15 29.62 5.07 -8.66 -1.6 0
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168364 74957243 1 ON6H28C30 AB6C28D30 137.07 7.77 -8.43 -1.1 0
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168365 74957246 1 FSCl2N5O5C28H30 ABC2D5E5F28G30 -202.17 5.48 -9.11 -1.28 -4
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168366 74957833 1 CoN11O15C55H68 AB11C15D55E68 -279.31 35.65 -8.46 -4.08 0
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168367 74958001 1 SO4N6C35H50 AB4C6D35E50 -145.66 4.68 -7.94 0.11 0
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168368 74958010 1 ClSN3O4C53H58 ABC3D4E53F58 -36.6 0.46 -8.65 -1.12 0
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168369 74958024 2 FON2C11H15 ABC2D11E15 -141.1 2.89 -9.02 0.06 0
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168370 74958461 1 BrO2N3H12C17 AB2C3D12E17 30.15 5.3 -8.88 -1.67 1
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168373 74959017 1 FN5O5C27H32 AB5C5D27E32 -210.33 4.81 -8.7 -0.77 0
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168374 74959083 1 SCl2N6O6C40H54 AB2C6D6E40F54 -301.84 6.69 -9.49 -0.75 0
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168375 74959794 1 N2O2H16C17 A2B2C16D17 -15.63 2.73 -9.62 -0.4 0
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168376 74959795 1 O2N5H13C16 A2B5C13D16 124.45 13.86 -8.94 -1.96 0
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168377 74959796 1 NO4H17C19 AB4C17D19 -70.11 3.28 -9.74 -0.22 0
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168378 74959797 2 N2O3H16C17 A2B3C16D17 -91.61 7.63 -9.35 -1.1 0
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168379 74959798 2 N2O2C6H7 A2B2C6D7 -90.43 5.37 -8.97 -1.23 0
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168380 74959799 1 SO4C22H30 AB4C22D30 -148.38 4.36 -8.61 0.14 1
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168381 74959822 1 NC25H32 AB25C32 58.12 2.83 0.0 0.0 0
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168382 74959823 2 O2C15H25 A2B15C25 -254.47 3.54 -9.26 0.43 0
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168383 74959824 5 OC6H10 AB6C10 -301.89 4.9 -9.39 0.62 0
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168384 74960069 1 O3C12H20 A3B12C20 -151.36 1.66 -9.72 1.16 0
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168385 74960076 1 S3N4H18C30 A3B4C18D30 235.21 5.58 -8.39 -1.75 4
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168386 74960102 1 PtN2O2C15H22 AB2C2D15E22 20.99 6.71 -8.91 -2.64 0
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168387 74960103 1 PtN2O4C16H20 AB2C4D16E20 100.63 14.1 -9.37 -3.6 4
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168388 74960104 1 PtN2O4C15H22 AB2C4D15E22 -44.54 13.71 -7.31 -2.42 0
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168389 74960802 1 SP3N7O19C39H64 AB3C7D19E39F64 -1024.5 7.71 -9.51 -0.94 0
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168390 74960803 2 OC11H16 AB11C16 -92.0 1.08 -8.37 0.13 0
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168391 74961072 1 O3C25H26 A3B25C26 -71.23 3.21 -9.02 -1.82 0
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168392 74961433 1 NO5C19H25 AB5C19D25 -194.72 4.43 -9.05 -0.59 0
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168393 74961434 1 NF3O4C19H22 AB3C4D19E22 -315.09 5.46 -10.36 -1.12 0
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168394 74961435 1 NO4C19H25 AB4C19D25 -163.17 2.93 -9.42 -0.6 0
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168395 74961748 2 O4C10H13 A4B10C13 -325.84 2.37 -9.69 -0.36 0
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168396 74961749 1 Cl2O4N5C15H27 A2B4C5D15E27 -243.01 6.88 -9.17 0.35 0
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168397 74961789 1 N2O6C23H26 A2B6C23D26 -207.86 4.53 -9.84 -0.26 0
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168398 74962344 1 Cl2F3N3O3H22C25 A2B3C3D3E22F25 -222.78 3.49 -9.8 -1.44 0
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168399 74962345 1 O12C41H66 A12B41C66 -606.96 6.07 -9.59 0.84 0
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168400 74962346 2 NO2C8H9 AB2C8D9 -102.78 5.83 -9.3 -1.1 0
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168401 74962578 1 NO3C24H47 AB3C24D47 -187.19 4.95 -9.57 0.5 0
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168402 74962579 1 NOCl2C26H49 ABC2D26E49 -155.57 2.93 -9.56 0.5 0
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168403 74962696 1 O2N4C25H32 A2B4C25D32 -24.42 6.54 -8.43 -0.72 0
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168404 74962846 2 N5O7C29H46 A5B7C29D46 -653.07 8.43 -9.24 -1.54 0
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168405 74963662 1 NO2C10H11 AB2C10D11 -50.62 2.75 -9.21 -0.51 0
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168406 74964205 1 F3N3O7C28H32 A3B3C7D28E32 -399.34 10.83 -9.5 -0.32 0
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168407 74965043 1 SN3F4O8C26H27 AB3C4D8E26F27 -488.27 11.1 -10.07 -1.37 0
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168408 74965109 1 F3N4O7C27H29 A3B4C7D27E29 -404.89 4.83 -8.79 -1.24 0