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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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47193 10530584 1 N2O8C29H40 A2B8C29D40 -360.85 7.52 -9.7 0.0 0
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47194 10530587 1 O3N4H32C34 A3B4C32D34 -32.75 4.96 -8.85 -1.03 0
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47195 10530595 1 SiO4C33H56 AB4C33D56 -270.32 5.09 -9.0 -0.35 0
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47196 10530596 1 SiO3C34H60 AB3C34D60 -270.68 4.42 -8.35 0.72 0
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47197 10530598 1 PSCl2N2O9H11C19 ABC2D2E9F11G19 -183.07 4.23 -9.14 -1.86 0
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47198 10530604 1 F3N3O7C25H34 A3B3C7D25E34 -446.54 10.36 -9.49 0.04 0
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47199 10530608 1 N3O6C30H47 A3B6C30D47 -316.32 7.29 -9.48 0.14 0
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47200 10530610 1 SN3O3C32H39 AB3C3D32E39 -82.89 8.49 -8.52 -0.43 0
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47201 10530614 1 ClS3O4N5H16C22 AB3C4D5E16F22 36.15 5.54 -9.14 -1.82 0
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47202 10530615 1 ClN5O5C27H36 AB5C5D27E36 -211.93 1.78 -9.14 -1.18 0
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47203 10530625 1 N2O8C29H42 A2B8C29D42 -348.13 6.23 -9.09 -1.88 0
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47204 10530626 2 NO3C16H19 AB3C16D19 -47.14 4.19 -7.9 -1.72 0
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47205 10530630 1 PSiO2N4C30H39 ABC2D4E30F39 -73.04 0.47 -8.87 -0.36 0
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47206 10530632 3 O2C11H18 A2B11C18 -340.32 1.43 -9.72 1.1 0
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47207 10530636 1 SiO3C35H50 AB3C35D50 -187.92 1.23 -8.99 0.14 0
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47208 10530638 1 Si2O7C27H54 A2B7C27D54 -489.22 3.74 -8.67 0.44 0
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47209 10530640 1 ClO2S2Si2N4C22H39 AB2C2D2E4F22G39 -155.27 5.94 -8.95 -1.25 0
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47210 10530645 1 N5O8C26H37 A5B8C26D37 -303.75 4.08 -9.45 -0.99 0
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47211 10530651 1 NSiO3C34H49 ABC3D34E49 -135.94 3.81 -8.9 0.22 0
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47212 10530654 1 ClNO9C27H30 ABC9D27E30 -373.04 4.12 -8.93 -1.9 0
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47213 10530658 1 BIN2O2H26C27 ABC2D2E26F27 63.13 7.52 -8.53 -0.91 0
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47214 10530672 1 SiO2H32C38 AB2C32D38 19.48 3.21 -8.92 -0.59 0
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47215 10530676 1 NO6H31C34 AB6C31D34 -127.71 4.59 -8.37 -0.65 0
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47216 10530685 1 BrClOS2N6H18C21 ABCD2E6F18G21 103.79 6.05 -9.02 -1.66 1
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47217 10530718 1 S2N5O7C23H30 A2B5C7D23E30 -159.78 7.29 0.0 0.0 0
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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