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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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380712 134971240 1 NS2O5C26H43 AB2C5D26E43 -243.14 4.56 -8.87 0.04 0
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380713 134971241 1 NO5C18H33 AB5C18D33 -251.94 4.53 -9.9 0.51 0
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380714 134971242 2 O2C9H16 A2B9C16 -218.4 2.03 -9.67 0.89 0
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380715 134971243 1 SiO6C49H74 AB6C49D74 -316.24 3.43 -8.77 0.13 0
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380716 134971244 1 SiO6C50H76 AB6C50D76 -315.92 3.88 -8.6 0.03 0
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380717 134971245 1 N2O5C45H62 A2B5C45D62 -170.0 6.65 -9.19 0.13 0
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380718 134971246 2 O3C22H30 A3B22C30 -232.73 3.33 -9.17 0.0 0
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380719 134971247 1 NO5C16H27 AB5C16D27 -236.29 7.65 -9.72 0.11 0
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380720 134971248 1 NO9C36H57 AB9C36D57 -421.83 1.42 -9.27 -0.4 0
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380721 134971249 1 NO8C31H47 AB8C31D47 -354.96 4.69 -9.44 -0.47 0
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380722 134971250 1 NO6C24H33 AB6C24D33 -255.2 3.95 -9.75 -0.54 0
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380723 134971251 1 NO8C23H35 AB8C23D35 -383.86 7.61 -9.64 -0.01 0
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380724 134971252 1 NO8C23H35 AB8C23D35 -386.02 5.98 -9.87 0.0 0
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380725 134971253 2 OSC9H16 ABC9D16 -132.98 2.49 -8.86 0.03 0
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380726 134971254 1 NSiO8C23H39 ABC8D23E39 -394.6 4.69 -8.96 0.22 0
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380727 134971255 1 O17C61H94 A17B61C94 -718.91 8.11 -7.18 -1.23 0
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380728 134971256 1 ISiN2O4C16H27 ABC2D4E16F27 -232.75 5.13 -9.25 -1.26 0
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380729 134971257 1 N2S2Si2O4C23H42 A2B2C2D4E23F42 -293.13 5.96 -8.24 -0.32 0
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380730 134971258 1 N2Si2O5C20H36 A2B2C5D20E36 -317.82 9.24 -9.1 -0.05 0
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380731 134971259 1 O3C22H34 A3B22C34 -112.89 2.06 -9.35 0.35 0
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380732 134971260 1 O5C12H20 A5B12C20 -232.12 1.86 -10.15 -0.1 0
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380733 134971261 1 SiO5C18H34 AB5C18D34 -301.99 2.35 -8.98 -0.15 0
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380734 134971262 1 SiO5C18H36 AB5C18D36 -328.05 2.1 -8.92 0.78 0
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380735 134971263 1 F3O7C22H27 A3B7C22D27 -433.96 5.99 -10.14 -0.67 0
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380736 134971264 1 F3O7C22H27 A3B7C22D27 -432.74 3.81 -10.07 -0.57 0
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380737 134971265 1 O6C15H28 A6B15C28 -307.76 3.55 -9.95 0.6 0
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380738 134971266 1 SiO7C21H42 AB7C21D42 -414.58 3.03 -9.14 0.4 0
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380739 134971267 1 SN2O3H14C15 AB2C3D14E15 -51.82 1.6 -8.78 -1.07 0
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380740 134971269 1 AlSiO5H6 ABC5D6 -404.51 5.21 0.0 0.0 0
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380741 134971272 2 OC8H12 AB8C12 -104.07 0.97 -9.48 0.21 0
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380742 134971273 1 N2O7C13H14 A2B7C13D14 -128.89 5.98 -9.27 -1.41 0
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380743 134971274 1 NO3C13H19 AB3C13D19 -120.61 3.39 -9.92 0.36 0
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380744 134971275 1 NSO5C11H13 ABC5D11E13 -92.67 4.49 -8.92 -1.5 0
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380745 134971278 1 O5H18C20 A5B18C20 -144.44 3.63 -9.45 -0.65 0
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380746 134971279 1 SiO4C12H24 AB4C12D24 -208.8 1.87 -9.27 0.71 0
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380747 134971280 1 SiN2O5C17H28 AB2C5D17E28 -276.94 7.23 -9.3 -0.22 0
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380748 134971281 1 N2Si2O5C20H38 A2B2C5D20E38 -329.18 3.89 -9.15 -0.35 0
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380749 134971283 1 O5C26H40 A5B26C40 -205.01 1.46 -9.42 0.27 0
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380750 134971284 1 NCl3O6C25H34 AB3C6D25E34 -274.57 4.81 -9.27 -0.7 0
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380751 134971287 1 SN2O7C19H30 AB2C7D19E30 -282.66 2.07 -9.78 -1.52 0
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380752 134971290 2 O5C15H28 A5B15C28 -543.56 3.4 -9.8 0.02 0
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380753 134971291 1 O3C20H24 A3B20C24 -90.86 3.37 -9.32 0.35 0
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380754 134971292 1 SiO3C16H28 AB3C16D28 -166.98 5.27 -9.12 0.26 0
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380755 134971294 1 OPN2C16H33 ABC2D16E33 -137.54 4.51 -8.83 1.57 0
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380756 134971296 1 O3C13H14 A3B13C14 -88.05 3.34 -9.65 -0.24 0
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380757 134971300 1 O2N5C10H15 A2B5C10D15 27.89 7.9 -8.96 -0.54 0
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380758 134971301 1 NSO5C24H29 ABC5D24E29 -159.72 4.67 -8.2 -0.7 0
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380759 134971302 1 NO3C20H25 AB3C20D25 -109.97 2.88 -9.04 -0.01 0
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380760 134971304 1 NO5C21H25 AB5C21D25 -172.49 4.73 -9.61 -0.88 0
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380761 134971305 1 NO5C21H25 AB5C21D25 -201.26 5.87 -10.05 -0.95 0
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380762 134971306 1 N2O3C24H24 A2B3C24D24 -17.04 3.05 -9.53 -1.02 0
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380763 134971308 1 NO4C26H29 AB4C26D29 -108.15 5.29 -9.48 -0.77 0
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380764 134971310 1 ClNO3C24H26 ABC3D24E26 -62.83 2.87 -9.19 -0.36 0
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380765 134971312 1 NSO5C25H29 ABC5D25E29 -150.14 7.88 -9.63 -1.0 0
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380766 134971317 1 O3C19H32 A3B19C32 -136.85 3.3 -9.18 1.31 0
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380767 134971318 1 O2C19H32 A2B19C32 -127.33 1.45 -9.35 1.61 0
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380769 134971320 2 O2C9H10 A2B9C10 -63.29 5.8 -7.45 -1.47 0
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380770 134971322 1 NO10C31H45 AB10C31D45 -468.51 4.19 -9.41 -0.4 0
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380771 134971324 1 NO4C7H9 AB4C7D9 -60.92 4.79 -10.88 -0.65 0
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380772 134971326 1 Si2O3C33H62 A2B3C33D62 -288.25 2.82 -8.7 0.28 0
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380773 134971327 1 O5C23H34 A5B23C34 -195.56 4.6 -9.38 0.28 0
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380774 134971328 1 SiO3C27H46 AB3C27D46 -207.65 3.57 -8.9 0.48 0
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380775 134971331 2 OC10H11 AB10C11 -23.49 2.33 -9.09 0.23 0
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380776 134971332 3 OC9H10 AB9C10 -64.25 2.11 -9.3 0.17 0
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380777 134971333 1 O3C20H24 A3B20C24 -96.71 4.38 -9.3 0.1 0
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380778 134971334 2 OC3H6 AB3C6 -112.89 3.38 -10.3 2.53 0
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380780 134971338 1 OC17H18 AB17C18 13.34 1.9 -9.42 0.27 0
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380781 134971340 1 OC19H20 AB19C20 -10.37 1.56 -8.42 -1.05 0
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380782 134971341 2 SN3O5C26H31 AB3C5D26E31 -266.18 8.73 -8.72 -0.91 0
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380784 134971345 1 N2O2H10C11 A2B2C10D11 3.16 1.9 -8.78 -0.53 0
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380785 134971346 1 NO3C17H21 AB3C17D21 -39.8 2.42 -9.9 -0.11 0
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380786 134971347 1 NS2O4C17H31 AB2C4D17E31 -234.19 5.82 -8.72 0.17 1
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380787 134971348 1 O2N5C10H16 A2B5C10D16 44.81 7.71 0.0 0.0 0
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380788 134971349 1 BrN2C17H19 AB2C17D19 48.87 2.85 -8.2 -0.37 0
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380789 134971350 1 O4C31H42 A4B31C42 -191.4 1.21 -9.34 0.18 0
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380790 134971351 1 O4C31H42 A4B31C42 -190.28 1.87 -9.37 0.35 0
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380791 134971352 1 O4C25H34 A4B25C34 -164.74 0.81 -9.3 -0.03 0
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380792 134971353 1 NO9H25C28 AB9C25D28 -294.05 6.71 -10.02 -1.06 0
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380793 134971354 1 SiO12C39H54 AB12C39D54 -508.05 1.94 -9.46 -0.7 0
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380794 134971355 1 SiO12C39H54 AB12C39D54 -516.21 2.76 -9.18 -0.66 0
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380795 134971357 1 BrSN2O2H11C16 ABC2D2E11F16 22.74 4.46 -9.09 -1.13 0
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380796 134971358 1 F2O3H10C13 A2B3C10D13 -145.81 2.45 -9.93 -1.19 -2
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380797 134971359 1 OYN2C15H17 ABC2D15E17 147.3 4.78 -5.44 -1.27 0
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380798 134971361 1 SiO6C31H60 AB6C31D60 -398.88 3.57 -8.87 0.26 0
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380799 134971363 1 NF3O10H32C42 AB3C10D32E42 -401.32 8.37 -9.63 -1.12 0
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380800 134971364 1 N3O8C18H27 A3B8C18D27 -339.46 4.12 -10.07 -0.6 0
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380801 134971365 1 N3O7C18H25 A3B7C18D25 -265.46 3.01 -9.9 -0.67 0
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380802 134971366 1 N4O9C21H28 A4B9C21D28 -336.6 5.51 -9.8 -0.97 0
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380803 134971367 1 O11C49H56 A11B49C56 -330.24 3.81 -9.27 0.08 0
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380804 134971369 1 O11C49H54 A11B49C54 -306.32 3.32 -9.05 -0.05 0
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380805 134971370 2 FO2H9C10 AB2C9D10 -175.95 5.56 -8.57 -1.08 0
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380806 134971371 1 O2N5C13H13 A2B5C13D13 25.11 9.77 -10.56 -1.64 0
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380807 134971372 1 NO3C6H11 AB3C6D11 -99.66 3.63 -9.56 0.44 0
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380808 134971373 1 SO4N6C52H62 AB4C6D52E62 -24.77 5.66 -8.57 -0.72 0
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380809 134971374 2 NO2C8H10 AB2C8D10 -123.94 2.3 -9.69 -0.4 0
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380810 134971375 1 Si2O5C19H42 A2B5C19D42 -371.93 1.87 -8.86 1.07 0
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380811 134971376 1 FO9C26H43 AB9C26D43 -522.78 4.94 -10.49 0.6 0
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380812 134971377 1 ClN2O5H9C12 AB2C5D9E12 -58.16 4.15 -10.38 -1.64 0
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380813 134971378 1 N2O7C14H14 A2B7C14D14 -125.15 5.57 -9.17 -1.3 1
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380814 134971379 1 N2C17H19 A2B17C19 58.25 3.61 0.0 0.0 0