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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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380290 134970698 1 N2O4C29H29 A2B4C29D29 37.43 4.62 0.0 0.0 0
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380291 134970699 1 N2O4C29H30 A2B4C29D30 -10.72 3.74 -9.54 -1.44 -1
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380292 134970701 1 N2O2C22H25 A2B2C22D25 -4.77 5.08 0.0 0.0 0
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380293 134970702 2 NOC11H13 ABC11D13 -24.03 5.74 -9.02 -0.29 -1
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380294 134970703 1 N2O4C36H37 A2B4C36D37 -66.56 2.98 0.0 0.0 0
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380295 134970704 2 NO2C18H19 AB2C18D19 -86.66 3.08 -9.06 -0.15 0
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380296 134970705 1 SiN3O5C22H35 AB3C5D22E35 -199.26 4.17 -8.86 -0.01 0
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380297 134970706 1 N3O5C16H21 A3B5C16D21 -130.2 4.31 -9.61 -0.29 0
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380298 134970707 1 SSiO8C23H38 ABC8D23E38 -407.02 3.8 -8.73 -0.16 0
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380299 134970708 1 SiO6C22H36 AB6C22D36 -323.9 2.63 -8.72 0.16 0
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380300 134970709 1 O2N4C39H62 A2B4C39D62 -110.92 2.68 -8.54 0.43 0
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380301 134970711 1 SiC9H20 AB9C20 -44.19 0.25 -9.55 1.62 0
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380303 134970713 1 OC8H16 AB8C16 -65.63 2.39 -10.01 2.47 0
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380304 134970714 1 F2O2H12C13 A2B2C12D13 -128.81 3.08 -9.8 -0.55 0
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380305 134970715 1 NO7C14H19 AB7C14D19 -260.16 4.22 -9.04 -0.25 1
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380306 134970716 1 NO4C19H22 AB4C19D22 -64.38 1.61 0.0 0.0 0
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380307 134970717 1 ON2C20H23 AB2C20D23 33.6 4.26 0.0 0.0 0
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380308 134970718 1 INOC9H15 ABCD9E15 -0.86 1.7 0.0 0.0 0
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380309 134970719 1 Si5O7C46H100 A5B7C46D100 -684.64 4.32 -8.69 0.45 0
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380310 134970720 1 Si5O7C52H112 A5B7C52D112 -704.03 1.94 -8.7 0.99 0
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380311 134970721 1 Si5O7C52H112 A5B7C52D112 -714.7 3.23 -8.71 0.9 0
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380312 134970722 3 OC4H8 AB4C8 -190.16 2.16 -9.92 1.77 0
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380313 134970723 1 ClNO2C15H18 ABC2D15E18 -82.35 4.97 -9.32 -0.22 0
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380314 134970724 1 NSCl3O6C25H28 ABC3D6E25F28 -234.34 3.97 -8.86 -0.56 0
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380315 134970725 1 NSCl3O7C27H32 ABC3D7E27F32 -295.35 3.22 -9.05 -0.46 0
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380316 134970726 1 O10C21H26 A10B21C26 -421.41 1.03 -9.42 0.26 0
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380317 134970727 1 SO5C22H26 AB5C22D26 -162.93 1.17 -8.65 -0.1 0
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380318 134970728 1 SN3O4C22H25 AB3C4D22E25 -43.64 2.77 -9.09 -0.12 0
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380319 134970729 1 SO8C21H28 AB8C21D28 -340.96 3.09 -8.92 0.27 0
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380320 134970730 1 SO5C15H22 AB5C15D22 -200.91 4.5 -9.31 -0.06 0
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380321 134970731 1 SN3O5C24H29 AB3C5D24E29 -99.46 2.32 -8.8 -0.02 0
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380322 134970732 1 SN3O5C24H29 AB3C5D24E29 -101.86 3.69 -9.31 -0.24 0
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380323 134970733 1 NSO5C24H31 ABC5D24E31 -179.46 3.78 -8.72 -0.14 0
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380324 134970734 1 SN3O5C24H31 AB3C5D24E31 -138.86 1.6 -9.1 0.14 0
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380325 134970735 1 SN3O5C24H31 AB3C5D24E31 -121.77 3.75 -8.89 0.23 0
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380326 134970736 2 ClN2O2H4C10 AB2C2D4E10 1.74 5.5 -8.69 -2.19 1
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380328 134970738 1 Cl2N4C37H39 A2B4C37D39 250.88 5.88 0.0 0.0 0
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380329 134970739 1 Cl2N4C37H40 A2B4C37D40 143.25 2.32 -8.4 -1.19 -1
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380330 134970740 1 O2N4C37H41 A2B4C37D41 75.86 3.62 0.0 0.0 0
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380331 134970741 1 O2N4C37H42 A2B4C37D42 61.35 3.92 -8.09 -1.34 0
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380332 134970742 1 NO3C15H19 AB3C15D19 -116.45 4.55 -10.32 0.03 0
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380334 134970745 1 O3C14H24 A3B14C24 -156.82 2.47 -9.89 0.99 -1
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380335 134970746 1 YC11H15 AB11C15 47.37 19.66 -4.67 -1.79 0
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380336 134970747 1 BrNO3C15H16 ABC3D15E16 -106.76 4.35 -9.74 -0.56 0
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380337 134970748 1 BO3C12H19 AB3C12D19 -99.25 4.58 -7.52 0.2 0
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380338 134970749 1 BO3C9H15 AB3C9D15 -107.87 2.67 -6.96 0.59 0
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380339 134970753 2 OC10H15 AB10C15 -107.44 6.47 -9.28 -0.38 0
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380340 134970754 2 OC10H15 AB10C15 -112.61 6.88 -9.12 -0.36 0
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380341 134970755 1 O3C20H30 A3B20C30 -157.42 5.64 -9.08 -0.8 0
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380342 134970757 1 LiO4C14H15 AB4C14D15 -111.08 8.02 -7.63 0.56 0
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380343 134970758 2 O2C7H8 A2B7C8 -119.57 2.18 -8.52 -0.25 0
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380344 134970759 1 LiSiN2C20H33 ABC2D20E33 -22.77 6.97 -7.1 1.12 0
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380345 134970760 1 O3N4C9H10 A3B4C9D10 41.65 3.07 -10.32 -0.9 0
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380346 134970761 1 NSSiO5C23H39 ABCD5E23F39 -258.51 6.2 -9.06 -0.49 0
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380347 134970762 1 NSSiO5C23H39 ABCD5E23F39 -256.5 5.09 -8.71 -0.72 0
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380348 134970765 1 NSSiO7C28H47 ABCD7E28F47 -372.07 3.12 -8.95 -0.44 0
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380349 134970769 1 NO5C11H19 AB5C11D19 -209.66 5.22 -10.3 0.65 0
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380350 134970772 2 NO2H7C8 AB2C7D8 44.75 4.36 -9.82 -0.97 0
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380351 134970773 1 NO6C14H25 AB6C14D25 -276.5 4.71 -9.98 -0.05 0
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380352 134970775 1 IO2C9H17 AB2C9D17 -84.23 2.29 -9.21 -0.54 0
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380353 134970776 1 SnO2C21H44 AB2C21D44 -144.08 0.27 -9.2 1.0 0
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380354 134970777 1 SnO2C21H44 AB2C21D44 -137.48 2.82 -9.29 0.94 0
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380355 134970778 1 IO2C9H17 AB2C9D17 -85.82 3.28 -9.39 -0.68 0
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380356 134970779 1 O5C18H18 A5B18C18 -134.83 4.71 -9.41 -0.34 1
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380358 134970781 1 SN2O5C23H30 AB2C5D23E30 -185.52 7.73 -9.7 -0.47 0
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380359 134970782 1 SN2O5C23H30 AB2C5D23E30 -186.37 2.98 -9.56 -0.33 0
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380360 134970783 1 BSiO3C18H33 ABC3D18E33 -172.09 3.16 -7.24 0.61 2
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380361 134970785 1 NRhP2C27H29 ABC2D27E29 25.96 37.49 0.0 0.0 -1
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380362 134970786 1 YC10H17 AB10C17 69.98 8.22 -5.38 0.55 0
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380363 134970788 2 C10H17 A10B17 -47.61 0.85 -8.93 1.56 0
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380364 134970789 1 OC21H36 AB21C36 -73.58 1.91 -8.94 1.24 0
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380365 134970790 2 OC10H17 AB10C17 -138.15 1.58 -8.87 1.72 0
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380366 134970791 1 O3C20H30 A3B20C30 -152.42 5.33 -9.29 -0.83 0
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380367 134970792 1 Si2O3C29H42 A2B3C29D42 -175.92 3.47 -9.02 0.07 0
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380368 134970794 1 LiNSC7H10 ABCD7E10 30.79 7.95 -7.38 1.72 0
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380369 134970795 2 O3H5C6 A3B5C6 -193.08 4.53 -8.85 -1.3 0
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380370 134970796 1 NOC19H25 ABC19D25 -10.21 2.89 -8.71 0.17 -2
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380371 134970797 1 NC5H11 AB5C11 7.54 1.89 -8.3 1.43 0
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380372 134970800 1 BrO13C27H45 AB13C27D45 -589.11 5.37 -9.67 -0.76 -1
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380373 134970801 1 WN2O2C6H11 AB2C2D6E11 146.36 3.16 0.0 0.0 0
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380374 134970803 1 O4C15H24 A4B15C24 -204.36 3.76 -9.76 0.5 0
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380375 134970804 1 O4C15H26 A4B15C26 -219.99 3.61 -9.83 1.97 0
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380376 134970805 1 O3C15H26 A3B15C26 -172.92 1.73 -9.38 2.0 0
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380377 134970807 1 BrSiO3C34H43 ABC3D34E43 -102.5 5.09 -8.94 -0.16 0
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380378 134970811 1 O4C23H30 A4B23C30 -82.93 2.92 -8.76 0.3 0
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380379 134970812 1 OLi2H4C6 AB2C4D6 10.3 13.34 -5.57 2.19 0
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380380 134970813 1 LiN3C11H16 AB3C11D16 40.47 5.63 -7.46 1.45 0
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380381 134970814 1 N3C8H9 A3B8C9 79.41 2.2 -8.41 -0.38 0
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380382 134970815 2 ON2C8H8 AB2C8D8 96.42 6.01 -8.26 -0.51 0
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380383 134970817 1 IO5H15C17 AB5C15D17 -111.23 6.67 -9.31 -1.48 0
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380384 134970818 1 ISiO7C26H33 ABC7D26E33 -266.74 4.45 -9.06 -1.11 0
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380385 134970819 1 O3C18H22 A3B18C22 -70.95 3.7 -8.65 0.14 0
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380386 134970820 1 SiO4C16H32 AB4C16D32 -231.86 3.15 -8.78 0.42 0
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380388 134970823 1 NPO5H46C47 ABC5D46E47 -92.82 1.3 -8.71 0.08 0
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380389 134970824 1 OPC20H25 ABC20D25 -8.45 2.83 -8.48 0.27 0
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380390 134970827 1 PC20H25 AB20C25 24.06 1.37 -8.53 0.2 0
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380391 134970828 1 PC25H27 AB25C27 57.47 1.59 -8.52 0.21 0
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380392 134970829 1 PC25H27 AB25C27 55.62 1.49 -8.49 0.25 0
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380393 134970832 1 SO6C20H30 AB6C20D30 -269.91 9.75 -9.82 -0.21 0
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380394 134970833 2 LiH4C7 AB4C7 133.41 3.73 -7.94 0.56 0