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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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45083 10507834 1 SiO6C36H46 AB6C36D46 -267.68 6.22 -9.06 -0.4 0
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45084 10507841 1 SiO3C39H58 AB3C39D58 -185.65 5.24 -8.96 0.08 0
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45085 10507856 1 SN4O4F6C26H26 AB4C4D6E26F26 -347.92 7.59 -9.22 -0.84 0
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45086 10507857 1 F3N4O7C29H31 A3B4C7D29E31 -402.8 3.62 -9.37 -1.81 0
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45087 10507862 1 PSiO11C27H45 ABC11D27E45 -574.85 2.89 -9.66 0.04 0
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45088 10507903 1 BO2Si2C36H75 AB2C2D36E75 -323.52 2.34 -8.68 0.56 0
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45089 10507905 1 ION3S3C25H26 ABC3D3E25F26 57.18 26.71 -6.57 -2.06 0
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45090 10507927 1 O9C35H44 A9B35C44 -365.79 1.73 -9.42 -0.83 0
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45091 10507946 1 NSi2F3O4C31H46 AB2C3D4E31F46 -401.85 5.86 -8.67 -0.3 0
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45092 10507951 1 F3O11C29H29 A3B11C29D29 -575.01 5.19 -10.02 -1.56 0
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45093 10507960 1 N4O7C33H46 A4B7C33D46 -308.75 3.51 -9.73 -0.29 0
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45095 10507982 1 BrN3O4H30C33 AB3C4D30E33 -83.02 6.33 -9.16 -0.83 0
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45096 10507983 3 O4H8C11 A4B8C11 -401.74 2.89 -9.61 -2.05 2
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45097 10508002 1 FeOSSnC29H42 ABCDE29F42 18.38 5.23 -6.66 -0.24 0
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45098 10508008 1 BrPO6C29H58 ABC6D29E58 -436.27 5.63 -9.72 -0.4 0
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45099 10508027 1 O10H34C35 A10B34C35 -241.18 1.96 -8.49 -0.13 0
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45100 10508028 2 O2N4H15C17 A2B4C15D17 59.8 5.52 -8.73 -1.28 0
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45101 10508032 1 SO6C37H42 AB6C37D42 -166.58 1.65 -9.02 0.14 0
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45102 10508035 1 O8C35H66 A8B35C66 -473.58 5.28 -10.03 -0.49 0
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45103 10508037 1 ClO6C36H51 AB6C36D51 -66.76 40.18 -9.16 -3.49 -1
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45104 10508044 1 BC22H24 AB22C24 70.79 1.1 0.0 0.0 0
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45105 10508059 1 N4O15C23H44 A4B15C23D44 -674.06 5.66 -9.6 0.28 0
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45106 10508061 1 SN4O4H26C27 AB4C4D26E27 -35.14 2.42 -8.23 -0.73 0
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45107 10508076 1 NO10C34H35 AB10C34D35 -351.81 5.87 -9.5 -0.3 0
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45108 10508094 1 SN4O11C27H30 AB4C11D27E30 -291.25 5.23 -10.03 -1.64 0
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45109 10508095 1 F4N4O7C28H38 A4B4C7D28E38 -458.03 31.72 -8.81 -2.66 0
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45110 10508100 1 N2O6C37H50 A2B6C37D50 -199.96 5.27 -9.36 -0.17 0
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45111 10508113 1 ClN3O6C34H38 AB3C6D34E38 -131.23 21.92 -7.99 -1.5 0
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45112 10508114 1 N3O6C34H37 A3B6C34D37 -106.05 12.44 -8.93 -0.92 0
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45113 10508127 1 BBrN2O6C31H34 ABC2D6E31F34 -186.02 3.25 -8.18 -0.41 0
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45114 10508130 2 ClOS3H7C13 ABC3D7E13 12.43 3.5 -8.62 -2.14 0
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45115 10508146 1 SO5N8H26C31 AB5C8D26E31 59.03 5.48 -8.86 -1.27 0
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45116 10508147 1 SiF3N4O6C29H37 AB3C4D6E29F37 -433.12 7.63 -9.35 -1.62 0
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45117 10508154 2 O4C18H31 A4B18C31 -444.73 6.08 -9.38 1.08 0
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45118 10508168 1 NSSiO2C39H49 ABCD2E39F49 -60.28 3.39 -8.48 -0.27 0
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45119 10508169 1 Cl2O2N5H31C35 A2B2C5D31E35 31.67 0.84 -8.54 -1.73 0
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45120 10508174 2 NSO5C14H18 ABC5D14E18 -370.61 1.65 -8.49 -1.1 0
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45121 10508177 2 O3C20H24 A3B20C24 -200.06 5.22 -9.01 0.1 2
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45122 10508179 1 N2C31H34 A2B31C34 110.8 2.17 -6.05 -0.77 0
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45123 10508190 1 SN5O5C34H35 AB5C5D34E35 -107.19 3.76 -8.87 -0.76 0
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45124 10508191 1 N3O6C37H43 A3B6C37D43 -199.11 5.21 -9.25 -1.72 0
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45125 10508192 1 S2N3O7C31H35 A2B3C7D31E35 -248.69 10.41 -9.07 -1.02 0
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45126 10508193 1 O4N7C35H43 A4B7C35D43 -96.84 6.83 -9.0 -0.57 0
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45127 10508203 1 PN4O9C29H47 AB4C9D29E47 -492.86 3.86 -9.6 0.02 0
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45128 10508210 1 N3O16C24H41 A3B16C24D41 -738.21 8.88 -10.02 0.08 0
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45129 10508220 1 N2O7C36H56 A2B7C36D56 -344.68 11.01 -9.92 -0.28 0
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45130 10508221 1 SiN2O4C37H64 AB2C4D37E64 -269.59 3.22 -8.18 -0.87 0
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45131 10508223 1 ClO12C30H41 AB12C30D41 -554.92 5.87 -10.01 0.16 0
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45132 10508231 1 NSSiO5C36H43 ABCD5E36F43 -198.24 8.17 -8.95 -1.19 0
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45133 10508241 1 FO4N8C33H39 AB4C8D33E39 -135.61 9.89 -8.65 -1.14 1
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45134 10508252 1 SeN2C29H31 AB2C29D31 77.49 1.43 0.0 0.0 0
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45135 10508270 1 SN3O3H8C15F17 AB3C3D8E15F17 -900.15 1.76 -9.69 -1.25 0
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45136 10508271 1 Br2Cl2N4C25H46 A2B2C4D25E46 1.82 6.09 -8.3 -1.0 0
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45137 10508273 1 PCl2N2O5C32H39 AB2C2D5E32F39 -237.76 6.14 -9.34 -0.31 1
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45138 10508307 1 ON4C35H45 AB4C35D45 30.23 1.42 0.0 0.0 0
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45139 10508310 2 NO3H16C20 AB3C16D20 -96.75 6.72 -9.52 -1.6 0
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45140 10508320 1 N2Si2O3C37H60 A2B2C3D37E60 -215.68 0.96 -8.74 0.19 0
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45141 10508355 1 N8H36C41 A8B36C41 295.4 12.19 -8.87 -0.85 0
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45142 10508356 1 O4N6C37H48 A4B6C37D48 -138.46 8.07 -8.57 -0.26 0
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45143 10508357 1 KSO7C34H49 ABC7D34E49 -390.47 13.65 -9.76 -0.33 0
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45144 10508360 1 ClN2O8C34H41 AB2C8D34E41 -297.45 3.57 -8.69 -0.2 0
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45145 10508373 2 N2O2C20H21 A2B2C20D21 20.36 4.59 -8.56 -0.68 0
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45146 10508411 1 SN6O7C31H46 AB6C7D31E46 -318.42 4.61 -8.88 -1.32 0
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45147 10508422 1 SiN3O4C39H45 AB3C4D39E45 -129.66 4.6 -9.0 -0.92 0
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45148 10508456 1 O7C40H58 A7B40C58 -334.85 1.7 -8.88 -0.54 0
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45149 10508465 1 ClNO10C33H46 ABC10D33E46 -484.78 5.54 -9.48 -0.43 0
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45150 10508477 1 S2O3N8H32C33 A2B3C8D32E33 59.23 6.61 -8.3 -1.24 0
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45151 10508497 1 SiF3O6C36H41 AB3C6D36E41 -359.29 3.23 -8.99 -0.31 0
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45152 10508501 2 O5C18H31 A5B18C31 -523.45 3.18 -9.81 0.74 0
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45153 10508503 1 N2S3O7C31H46 A2B3C7D31E46 -316.44 6.78 -8.78 -1.64 0
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45154 10508506 2 SiO3C18H35 AB3C18D35 -455.27 1.42 -8.78 1.04 0
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45155 10508510 1 N3O9C34H61 A3B9C34D61 -509.86 5.75 -9.78 -0.1 0
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45156 10508546 1 SiO8C37H58 AB8C37D58 -414.52 2.66 -8.64 -0.1 0
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45157 10508551 1 ClO14C30H39 AB14C30D39 -589.67 8.17 -10.52 -0.07 0
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45158 10508552 1 ClS4O6N8C22H23 AB4C6D8E22F23 -86.54 9.62 -8.84 -1.12 0
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45159 10508561 1 ClO4N5C37H46 AB4C5D37E46 -115.74 13.43 -8.4 -0.51 0
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45160 10508584 1 F3N4O5C36H37 A3B4C5D36E37 -231.19 3.49 -7.93 -1.66 0
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45161 10508586 1 N2O12C33H46 A2B12C33D46 -458.68 5.84 -9.13 -0.73 0
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45162 10508603 1 N2O9H36C38 A2B9C36D38 -245.74 6.23 -8.69 -0.8 0
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45163 10508604 1 O8N10C29H48 A8B10C29D48 -192.43 2.67 -9.68 -0.97 0
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45164 10508613 1 FO3C19H37 AB3C19D37 -261.37 1.57 -10.22 0.77 0
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45165 10508615 1 IN3O3S3C27H28 AB3C3D3E27F28 -32.48 9.92 -6.82 -1.89 0
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45166 10508622 1 N4O7C37H54 A4B7C37D54 -331.0 3.43 -9.48 0.02 0
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45167 10508628 1 PN5O16C20H32 AB5C16D20E32 -752.54 9.87 -10.02 -1.09 0
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45168 10508648 1 NO7H39C42 AB7C39D42 -53.84 4.85 -7.32 -1.36 0
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45169 10508652 1 NO7C41H51 AB7C41D51 -285.94 1.05 -9.53 -0.58 0
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45170 10508685 1 SB2O2C43H72 AB2C2D43E72 -200.95 2.67 -7.96 0.26 0
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45171 10508697 1 N5O6C39H41 A5B6C39D41 -186.45 7.16 -8.6 -0.79 0
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45172 10508702 1 ClN3O5H38C40 AB3C5D38E40 -77.3 8.03 -8.57 -0.56 0
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45173 10508716 1 N3O6C38H65 A3B6C38D65 -343.87 6.12 -8.64 0.51 0
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45174 10508746 1 O12C37H44 A12B37C44 -413.76 8.14 -8.69 -0.39 0
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45175 10508748 2 O4C21H24 A4B21C24 -184.24 5.39 -8.83 -0.92 0
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45176 10508757 1 SiN3O5C40H51 AB3C5D40E51 -133.13 4.16 -8.65 0.19 0
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45177 10508766 1 SSi2O5C38H58 AB2C5D38E58 -225.51 4.3 -8.52 -0.25 0
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45178 10508767 1 O3C46H82 A3B46C82 -309.16 1.45 -9.53 1.01 0
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45179 10508822 1 N6O8H32C37 A6B8C32D37 -169.05 5.55 -9.11 -1.33 0
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45180 10508833 1 N7O9C33H51 A7B9C33D51 -417.12 2.09 -9.13 -0.26 0
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45181 10508835 1 PSi2N3O7C33H52 AB2C3D7E33F52 -444.83 3.25 -8.78 -0.52 0
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45182 10508848 4 NO2H7C10 AB2C7D10 -196.82 7.81 -7.75 -0.81 1
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45183 10508856 1 PN3C13H24 AB3C13D24 20.91 11.18 -6.84 0.69 0