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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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47218 10530720 1 NSO7C30H33 ABC7D30E33 -254.28 9.01 -9.52 -0.77 0
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47219 10530724 1 N3O6C31H41 A3B6C31D41 -215.59 0.72 -9.54 -0.26 0
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47220 10530726 1 NSO4H33C34 ABC4D33E34 -63.95 6.12 -8.23 -0.75 0
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47221 10530727 1 ON3H37C38 AB3C37D38 102.68 2.4 -8.52 -0.14 0
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47222 10530728 1 ON3H37C38 AB3C37D38 103.05 3.51 -8.47 -0.09 1
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47223 10530730 1 ON3S3C26H26 AB3C3D26E26 54.46 7.27 0.0 0.0 0
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47224 10530740 1 O4N6C31H32 A4B6C31D32 -58.41 3.13 -8.67 -0.93 0
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47225 10530741 1 FO3N4C33H33 AB3C4D33E33 -88.48 4.64 -8.74 -0.31 0
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47226 10530754 1 O5N9C26H35 A5B9C26D35 -154.43 7.01 -8.91 -0.67 0
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47227 10530758 1 NS2O7H27C28 AB2C7D27E28 -196.39 11.96 -9.57 -0.82 0
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47228 10530764 1 NO5C33H63 AB5C33D63 -365.91 3.59 -10.14 0.25 0
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47229 10530767 1 ClNO6C31H36 ABC6D31E36 -203.54 5.36 -8.92 -0.87 0
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47230 10530769 1 AgS2N5O5H16C18 AB2C5D5E16F18 -174.6 14.75 -8.91 -3.58 0
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47231 10530777 1 BrSN3C30H40 ABC3D30E40 66.6 4.66 -6.69 -0.78 0
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47232 10530780 1 O9C30H50 A9B30C50 -453.49 2.2 -9.61 0.22 0
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47233 10530781 1 O3N4C34H42 A3B4C34D42 -68.68 3.61 -9.16 0.1 0
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47234 10530787 1 SCl2N2O5H20C27 AB2C2D5E20F27 -33.97 5.41 -8.95 -1.78 0
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47235 10530802 1 N3O6C31H45 A3B6C31D45 -206.45 1.82 -8.78 0.11 0
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47236 10530809 1 Cl2S2O3N5H15C24 A2B2C3D5E15F24 105.36 6.79 -8.28 -1.24 0
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47237 10530810 1 FSN2O11C23H25 ABC2D11E23F25 -491.82 9.37 -10.17 -1.08 0
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47238 10530814 1 O8H32C33 A8B32C33 -208.99 4.97 -8.84 -0.29 0
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47239 10530822 2 NO4C15H20 AB4C15D20 -291.39 3.57 -9.75 -0.29 0
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47240 10530824 1 N2O6C33H36 A2B6C33D36 -150.06 1.08 -9.2 -0.56 0
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47241 10530826 4 O2C8H11 A2B8C11 -362.38 6.46 -8.87 0.1 0
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47242 10530857 2 NSeO4C9H16 ABC4D9E16 -392.54 4.53 -8.89 -1.97 0
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47243 10530858 2 NO6C13H13 AB6C13D13 -408.22 6.65 -9.24 -2.1 0
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47244 10530877 1 SiO4C35H46 AB4C35D46 -158.25 2.28 -8.92 0.27 0
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47245 10530880 1 SiO3C35H62 AB3C35D62 -235.31 3.52 -8.77 0.76 0
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47246 10530893 1 NO4C35H61 AB4C35D61 -292.4 3.73 -9.83 0.46 0
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47248 10530943 1 PN2O8H27C29 AB2C8D27E29 -200.56 6.92 -9.37 -1.39 0
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47249 10530944 1 S2N4O9H22C23 A2B4C9D22E23 -225.79 9.95 -9.96 -1.57 0
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47250 10530949 1 N6O6C29H34 A6B6C29D34 -186.51 8.97 -9.47 -0.48 0
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47251 10530950 1 S2N6O7C23H26 A2B6C7D23E26 -99.39 1.68 -8.99 -2.02 0
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47252 10530952 1 S3O5N8C21H22 A3B5C8D21E22 -37.74 8.12 -9.03 -0.93 0
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47253 10530956 1 SO6C33H38 AB6C33D38 -168.74 4.0 -9.02 -0.51 0
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47254 10530964 1 BrNaS2N6O6H12C17 ABC2D6E6F12G17 -95.37 8.99 -8.92 -1.12 0
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47255 10530972 1 FO5C34H57 AB5C34D57 -351.5 1.53 -9.62 0.13 0
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47256 10530980 4 O3C7H9 A3B7C9 -519.71 6.11 -10.39 -0.47 0
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47257 10530991 1 ClN4O6C29H29 AB4C6D29E29 -185.21 8.5 -8.48 -0.8 0
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47258 10530993 1 SBr2N3O3H19C22 AB2C3D3E19F22 -4.64 4.8 -8.36 -1.27 0
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47259 10530995 1 BrFO5N8C21H22 ABC5D8E21F22 -160.07 4.35 -8.92 -1.2 0
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47260 10530996 1 Cl2N2O7C27H30 A2B2C7D27E30 -262.79 12.11 -8.54 -0.66 0
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47261 10530999 1 BrSSiO4C27H37 ABCD4E27F37 -183.52 2.89 -8.56 -0.43 1
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47262 10531012 1 PN3O5C27H53 AB3C5D27E53 -258.28 11.61 0.0 0.0 1
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47264 10531023 1 N2O8C31H38 A2B8C31D38 -318.23 3.38 -9.55 -0.55 0
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47265 10531026 1 N2O5C35H38 A2B5C35D38 -114.81 7.12 -8.16 -1.43 0
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47266 10531028 2 OH15C21 AB15C21 88.96 1.7 -8.57 -0.64 0
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47267 10531030 2 NSO3C14H21 ABC3D14E21 -191.57 2.18 -8.07 -0.15 0
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47268 10531033 2 O2C18H35 A2B18C35 -335.99 2.35 -10.48 0.67 0
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47269 10531035 1 ClSN2O2H31C34 ABC2D2E31F34 23.66 1.96 -8.75 -0.76 0
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47270 10531036 1 OBr2N7H17C23 AB2C7D17E23 100.79 7.1 -8.65 -0.82 0
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47271 10531037 1 BrN2O6H27C28 AB2C6D27E28 -131.7 4.38 -8.79 -0.54 0
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47272 10531040 1 N5O9C27H29 A5B9C27D29 -313.58 4.75 -10.04 -1.18 0
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47273 10531042 1 SN3O6H25C31 AB3C6D25E31 -126.09 1.91 -9.31 -0.91 0
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47274 10531045 1 NO8C32H41 AB8C32D41 -263.92 5.75 -10.19 -1.79 0
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47275 10531048 1 N5O5C31H45 A5B5C31D45 -127.98 4.75 -8.72 -0.24 0
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47276 10531057 2 Cl2O2N4H5C10 A2B2C4D5E10 -18.54 2.73 -9.51 -1.61 0
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47277 10531063 1 N4O8C29H36 A4B8C29D36 -305.15 1.81 -9.04 -1.06 0
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47278 10531073 1 O5C36H56 A5B36C56 -272.11 4.15 -9.21 -0.12 0
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47279 10531082 1 NO6H27C36 AB6C27D36 -32.92 6.57 -8.99 -1.69 0
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47281 10531107 1 N2O5C35H42 A2B5C35D42 -135.19 5.12 -8.62 -0.65 0
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47282 10531109 2 N2O2C17H21 A2B2C17D21 -129.89 6.99 -9.17 -0.4 0
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47283 10531128 1 ISN3O5C22H26 ABC3D5E22F26 -86.32 4.74 -9.6 -0.8 0
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47284 10531135 1 S2F3N3O11C17H28 A2B3C3D11E17F28 -673.83 10.84 -9.95 -1.16 0
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47285 10531149 1 ClNO9C28H42 ABC9D28E42 -408.86 4.64 -8.64 -0.3 0
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47286 10531175 1 BO6N7C28H32 AB6C7D28E32 -249.75 7.67 -8.42 -0.53 0
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47287 10531194 1 SN2O10C27H30 AB2C10D27E30 -355.08 6.85 -8.75 -1.19 0
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47288 10531244 2 N2O4C15H16 A2B4C15D16 -267.13 4.63 -9.22 -0.84 0
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47289 10531253 1 ClO4F12C19H21 AB4C12D19E21 -816.88 3.59 -10.94 -1.0 0
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47290 10531254 1 SiO4C36H52 AB4C36D52 -220.36 4.55 -9.05 0.09 0
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47291 10531267 1 NO6C35H47 AB6C35D47 -254.97 5.85 -9.03 -0.94 0
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47292 10531275 2 O4C17H21 A4B17C21 -281.38 2.83 -9.57 -0.16 0
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47293 10531276 1 N2O9C30H46 A2B9C30D46 -461.69 3.79 -9.75 -0.17 0
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47294 10531280 1 Br3O4C21H23 A3B4C21D23 -168.86 2.52 -9.29 -1.2 0
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47295 10531287 1 N3O8C31H37 A3B8C31D37 -179.24 4.97 -8.1 -0.04 0
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47296 10531288 1 N3O6H33C34 A3B6C33D34 -160.01 6.16 -8.57 -0.26 0
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47297 10531293 1 N5O5C32H45 A5B5C32D45 -202.08 3.48 -8.26 -0.36 0
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47298 10531311 1 SN2O4C35H36 AB2C4D35E36 -81.76 4.3 -8.65 -0.54 0
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47299 10531326 2 NOH12C13 ABC12D13 19.19 1.18 -9.47 -0.75 0
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47300 10531327 1 NO4C36H71 AB4C36D71 -329.32 3.9 -9.77 0.24 0
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47301 10531331 1 O15C26H30 A15B26C30 -601.21 5.92 -9.02 -0.5 0
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47302 10531332 1 N4O11H26C27 A4B11C26D27 -183.32 15.19 -9.9 -2.13 0
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47303 10531343 1 N4O8C29H50 A4B8C29D50 -419.03 7.05 -9.23 -0.21 0
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47304 10531344 1 N2O5C36H42 A2B5C36D42 -169.95 4.17 -9.28 -0.55 0
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47305 10531345 1 SN2O4C35H38 AB2C4D35E38 -70.12 5.24 -9.04 -0.36 0
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47306 10531366 1 F3N4O6H27C29 A3B4C6D27E29 -337.53 4.94 -8.78 -1.38 0
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47307 10531368 1 SN2O10C28H28 AB2C10D28E28 -361.3 8.09 -9.39 -1.42 0
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47309 10531421 1 BrON2H9F10C22 ABC2D9E10F22 -391.76 2.07 -9.29 -1.45 0
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47310 10531423 1 FN5O12C22H42 AB5C12D22E42 -600.09 1.65 -9.54 0.29 0
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47311 10531434 1 ClSO2N5C32H34 ABC2D5E32F34 -3.47 5.51 -8.41 -0.45 0
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47312 10531439 1 Cl2N3O7C27H39 A2B3C7D27E39 -320.13 10.21 -8.58 -0.47 0
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47313 10531448 2 O2N3H16C17 A2B3C16D17 -18.36 5.96 -8.94 -0.7 0
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47314 10531453 1 SN2O5C33H46 AB2C5D33E46 -239.29 2.13 -8.78 -0.44 0
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47315 10531461 1 INO2C32H32 ABC2D32E32 18.92 3.46 -8.66 -0.6 0
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47316 10531483 2 OSiS2C14H19 ABC2D14E19 -76.83 4.27 -8.49 -1.63 0
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47317 10531499 1 ISN4O5C23H23 ABC4D5E23F23 -121.76 6.0 -8.99 -1.37 0
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47318 10531509 2 O2N3C17H18 A2B3C17D18 2.66 3.2 -8.52 -0.65 0
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47319 10531520 1 PNa2S2F3N5O7C16H21 AB2C2D3E5F7G16H21 -593.48 9.79 -8.21 -0.83 0
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47320 10531526 1 SH2O3C11F20 AB2C3D11E20 -1100.67 1.34 -12.04 -2.12 0
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47321 10531528 1 N6O7C30H38 A6B7C30D38 -254.92 6.26 -8.94 0.05 0