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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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48720 11528263 1 O27C62H98 A27B62C98 -1264.68 7.87 -9.29 -0.26 0
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48721 11528264 2 O6N9C31H44 A6B9C31D44 -485.22 11.34 -8.31 -0.35 0
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48722 11528265 1 BCrF4N4H76C84 ABC4D4E76F84 688.99 3.04 0.0 0.0 0
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48723 11528266 1 NCl3O27C55H68 AB3C27D55E68 -1163.0 3.68 -9.89 -0.66 0
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48724 11528267 1 N14O17C60H96 A14B17C60D96 -787.75 8.63 -9.43 -0.37 0
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48725 11528268 1 PO19N23C45H88 AB19C23D45E88 -909.61 10.7 -9.0 -0.81 1
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48726 11528269 1 NaI2S3N10O16C39H50 AB2C3D10E16F39G50 -463.54 10.51 0.0 0.0 0
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48727 11528270 1 MgO7N8C78H102 AB7C8D78E102 -200.97 1.48 -6.98 -2.04 0
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48728 11528271 1 O7N8C78H104 A7B8C78D104 -134.98 4.58 -7.45 -2.03 0
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48729 11528272 1 N12O13C66H120 A12B13C66D120 -681.03 13.39 -9.27 -0.12 0
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48731 11528274 1 NaS6N12O16H48C52 AB6C12D16E48F52 -256.81 7.8 0.0 0.0 2
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48732 11528275 2 S3N6O8H24C26 A3B6C8D24E26 -228.1 10.6 -7.5 -2.26 1
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48733 11528276 1 NaSI2F5N7O11H46C49 ABC2D5E7F11G46H49 -504.72 15.39 0.0 0.0 0
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48734 11528277 1 SN15O17C59H95 AB15C17D59E95 -748.78 7.84 -8.11 -0.89 0
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48735 11528278 1 NSi4O16C68H119 AB4C16D68E119 -891.64 6.52 -8.66 -0.42 0
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48736 11528279 1 SiO24C68H104 AB24C68D104 -1123.57 8.96 -7.19 -0.83 0
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48737 11528280 2 F3O5N6C34H43 A3B5C6D34E43 -724.73 10.79 -9.13 -0.91 0
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48738 11528281 2 N2O16C29H41 A2B16C29D41 -1388.59 5.2 -9.32 -0.9 0
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48739 11528282 1 P4N20O25C41H52 A4B20C25D41E52 -1038.67 3.03 -9.18 -0.96 0
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48740 11528283 1 P4N20O25C41H52 A4B20C25D41E52 -1067.94 12.85 -8.84 -1.32 0
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48741 11528284 1 PO5C89H171 AB5C89D171 -635.46 2.89 -8.37 0.17 -1
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48743 11528286 2 OSiC48H56 ABC48D56 470.6 26.72 -6.63 -2.43 0
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48745 11528288 1 O43C51H86 A43B51C86 -1898.57 14.86 -9.96 -2.02 0
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48746 11528289 1 SO9N13F19C51H62 AB9C13D19E51F62 -1296.69 7.05 -8.94 -0.81 0
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48747 11528290 1 ON2Si8C79H176 AB2C8D79E176 -536.59 4.42 -8.99 1.58 0
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48748 11528291 2 H49C55 A49B55 663.5 0.89 -8.43 -1.39 0
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48749 11528292 1 Cl2N3O27C66H83 A2B3C27D66E83 -1109.21 1.44 -9.65 -0.79 0
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48750 11528293 1 SN2Si2O15C79H122 AB2C2D15E79F122 -817.08 4.72 -8.75 0.04 0
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48751 11528294 1 PS2N13O16C67H92 AB2C13D16E67F92 -758.52 11.6 -8.98 -1.0 0
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48752 11528295 1 O12N16C75H116 A12B16C75D116 -621.27 8.31 -9.29 -0.01 0
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48753 11528296 2 NO7C43H78 AB7C43D78 -900.74 10.17 -9.21 0.44 0
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48754 11528297 1 N5O35C61H87 A5B35C61D87 -1471.06 21.85 -8.99 -1.63 0
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48755 11528298 1 SP2N13O20C64H89 AB2C13D20E64F89 -722.51 11.13 -8.44 -1.71 0
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48756 11528299 6 NSiC15H20 ABC15D20 56.41 0.92 -8.24 -0.89 0
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48757 11528300 1 NPO27C71H136 ABC27D71E136 -1400.91 11.71 -9.16 -0.14 0
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48758 11528301 1 P3O19C81H97 A3B19C81D97 -828.38 4.59 -8.96 -0.21 0
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48759 11528302 1 N12O15C80H118 A12B15C80D118 -731.89 13.73 -9.01 -0.56 0
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48760 11528303 1 ISO16C85H91 ABC16D85E91 -348.53 10.64 -8.8 -1.22 0
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48761 11528304 1 NO36C70H113 AB36C70D113 -1675.81 9.65 -9.37 0.18 0
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48762 11528305 1 O25C85H136 A25B85C136 -1221.65 6.51 -7.51 -0.09 0
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48763 11528306 1 N2P2O12C91H186 A2B2C12D91E186 -971.87 20.79 -8.99 -0.23 2
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48765 11528308 1 SO10N13C85H167 AB10C13D85E167 -732.11 5.15 -8.94 -0.25 0
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48767 11528310 1 P2N4O17C83H164 A2B4C17D83E164 -1199.68 8.15 -9.58 0.13 0
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48768 11528311 2 S3Si6C39H67 A3B6C39D67 -311.81 5.96 -7.38 -0.86 0
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48769 11528312 6 NO2C17H25 AB2C17D25 -481.06 12.25 -7.84 -0.99 0
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48770 11528313 1 ClN11O19C86H142 AB11C19D86E142 -946.96 10.46 -9.31 -0.76 0
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48771 11528314 3 ClN2S2O8C24H29 AB2C2D8E24F29 -701.59 25.73 -6.59 -2.33 3
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48772 11528315 3 ClSN2O4C24H28 ABC2D4E24F28 -268.49 22.82 0.0 0.0 0
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48774 11528317 1 BN4P5C18O25H26 AB4C5D18E25F26 -1280.07 9.62 -7.63 -1.25 0
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48775 11528318 1 S2N23O25C74H121 A2B23C25D74E121 -1051.98 13.79 -8.62 -1.57 0