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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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449738 135301066 1 FICl2P2N3O4C19H21 ABC2D2E3F4G19H21 -243.32 2.52 -8.72 -1.26 0
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449739 135301067 1 NO3C13H17 AB3C13D17 -80.3 2.38 -9.91 -0.92 0
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449740 135301069 1 N2O3C20H28 A2B3C20D28 -69.73 6.33 -8.59 -0.5 0
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449741 135301075 1 ClOC31H35 ABC31D35 10.06 2.36 -8.86 -0.07 0
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449742 135301086 2 O3N4C24H35 A3B4C24D35 -258.28 3.85 -8.74 -0.84 0
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449743 135301108 1 Cl2O3N4C28H30 A2B3C4D28E30 -34.28 6.69 -8.42 -0.61 0
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449744 135301111 1 SO2F3N7H18C30 AB2C3D7E18F30 47.22 11.41 -9.8 -1.86 0
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449745 135301112 1 NO6C20H25 AB6C20D25 -169.67 3.78 -9.32 -0.77 0
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449746 135301113 1 O3C13H16 A3B13C16 -93.07 3.05 -9.03 -0.58 0
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449747 135301116 2 O2C7H7 A2B7C7 -62.44 1.87 -8.57 -0.74 0
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449748 135301133 2 N3O4C26H35 A3B4C26D35 -329.36 2.99 -8.85 -0.73 0
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449749 135301138 1 OSF3N7H16C18 ABC3D7E16F18 -44.19 5.33 -8.56 -1.84 0
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449750 135301140 1 FO3C14H21 AB3C14D21 -186.25 3.44 -9.61 0.09 0
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449751 135301145 1 SN4C11H14 AB4C11D14 81.56 3.6 -8.72 -0.27 0
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449752 135301155 1 O6N8C41H48 A6B8C41D48 -139.94 3.02 -8.71 -0.42 0
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449753 135301156 2 O3N5C24H32 A3B5C24D32 -162.52 11.95 -8.52 -0.9 0
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449754 135301197 1 SO2F3N6H19C26 AB2C3D6E19F26 -16.91 8.44 -9.7 -1.67 0
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449755 135301207 1 NS2O4H11C12 AB2C4D11E12 -100.11 7.25 -9.26 -0.95 0
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449756 135301212 1 N7O11C48H61 A7B11C48D61 -271.73 10.13 -8.17 -0.74 0
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449757 135301219 2 O3N5C22H30 A3B5C22D30 -157.25 10.19 -8.6 -1.29 0
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449758 135301226 1 O5N6C44H62 A5B6C44D62 -224.9 8.74 -8.48 -0.44 0
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449759 135301230 1 BrSF3N4H14C16 ABC3D4E14F16 -82.51 7.86 -8.74 -1.53 0
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449760 135301240 1 NO2C10H19 AB2C10D19 -56.12 3.97 -8.78 0.33 0
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449761 135301242 1 NO3C20H31 AB3C20D31 -110.11 4.2 -8.94 0.01 0
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449762 135301243 1 FNO3H16C19 ABC3D16E19 -38.15 2.44 -8.6 -0.8 0
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449763 135301244 2 NOC5H9 ABC5D9 -70.24 4.8 -8.75 -0.03 0
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449764 135301254 1 NO5C22H29 AB5C22D29 -193.65 3.32 -8.99 -0.07 0
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449765 135301275 1 N6O7C42H60 A6B7C42D60 -307.29 5.43 -8.98 0.26 0
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449766 135301279 1 O2F3N6H19C31 A2B3C6D19E31 47.25 8.13 -9.11 -1.5 0
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449767 135301280 2 O3N5C23H34 A3B5C23D34 -229.74 8.55 -8.97 -1.48 0
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449768 135301284 1 NSO7C20H31 ABC7D20E31 -318.46 6.41 -9.08 -0.55 0
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449769 135301286 1 N3O6C32H57 A3B6C32D57 -330.55 3.05 -8.78 0.71 0
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449770 135301295 2 NO4C12H18 AB4C12D18 -345.78 5.32 -8.8 -0.95 0
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449771 135301299 1 N8C23H26 A8B23C26 119.41 3.42 -8.66 -0.91 0
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449772 135301310 1 NO3C13H23 AB3C13D23 -137.67 3.97 -9.61 0.31 0
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449773 135301325 2 FO3N4C25H34 AB3C4D25E34 -342.85 1.41 -8.86 -0.63 0
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449774 135301326 1 O2F4N5H15C24 A2B4C5D15E24 -73.51 9.92 -10.22 -1.56 0
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449775 135301329 1 OF2H10C11 AB2C10D11 -87.15 2.94 -9.6 -0.73 0
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449776 135301331 4 NC6H9 AB6C9 53.84 2.06 -8.19 0.12 0
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449777 135301342 1 N3O8C21H35 A3B8C21D35 -377.58 2.84 -9.78 -0.79 1
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449778 135301379 1 N4O4C15H27 A4B4C15D27 -152.41 1.88 0.0 0.0 0
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449779 135301383 1 N3O4C11H19 A3B4C11D19 -160.37 7.34 -9.73 -0.33 0
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449780 135301396 1 OC11H18 AB11C18 -49.26 2.43 -9.25 0.59 0
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449781 135301401 1 PN2O4C23H27 AB2C4D23E27 -77.95 7.39 -7.75 -1.1 0
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449782 135301402 1 N2C17H24 A2B17C24 40.85 2.14 -7.99 0.53 0
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449783 135301433 1 N2O2H16C17 A2B2C16D17 -7.93 2.87 -8.55 -0.44 0
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449784 135301440 1 ClO2N7C26H32 AB2C7D26E32 1.84 4.47 -8.9 -0.33 0
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449786 135301460 1 NO2C24H25 AB2C24D25 -53.11 4.4 -9.05 -0.74 0
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449787 135301467 1 NH21C28 AB21C28 186.43 4.27 -7.54 -1.13 0
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449788 135301487 1 N2H8C15 A2B8C15 270.04 2.68 -8.4 -1.71 0
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449789 135301488 1 NH17C22 AB17C22 161.5 3.7 -7.61 -1.19 0
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449790 135301489 1 NO2H17C21 AB2C17D21 98.18 9.78 -6.66 -2.19 0
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449791 135301498 1 NOSC6H13 ABCD6E13 -29.94 4.23 -8.48 0.31 0
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449792 135301523 1 ClO2N7C26H32 AB2C7D26E32 -0.17 7.4 -8.68 -0.29 0
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449796 135301563 1 NH11C13 AB11C13 156.27 2.33 -8.29 -0.45 0
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449797 135301583 1 F3O3C7H9 A3B3C7D9 -302.33 1.81 -10.67 0.16 0
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449798 135301601 1 ON6C26H26 AB6C26D26 104.17 11.72 -8.36 -1.79 0
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449800 135301605 1 O2F4N7C26H27 A2B4C7D26E27 -157.79 12.39 -8.79 -0.93 0
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449801 135301642 1 O2N3C20H31 A2B3C20D31 -112.74 1.81 -8.61 0.4 0
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449802 135301654 1 OSN7C18H27 ABC7D18E27 18.34 3.43 -8.31 -0.34 0
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449803 135301658 1 OSF3N5C20H24 ABC3D5E20F24 -159.51 4.48 -8.76 -0.43 0
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449804 135301659 1 SF3N4C23H25 AB3C4D23E25 -103.13 7.1 -8.91 -0.61 0
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449805 135301665 1 N3C13H19 A3B13C19 21.06 2.9 -8.24 0.12 0
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449806 135301686 1 O2N4C23H30 A2B4C23D30 -34.4 1.14 -8.45 -0.21 0
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449807 135301696 1 ON3F4H9C10 AB3C4D9E10 -167.28 4.42 -9.42 -1.48 0
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449808 135301698 1 ON3C15H21 AB3C15D21 41.76 4.1 -8.36 -0.31 0
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449809 135301711 1 ON3C17H21 AB3C17D21 63.73 5.34 -8.36 -0.02 0
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449810 135301732 2 FO4N5C25H32 AB4C5D25E32 -314.01 8.97 -8.23 -0.68 0
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449811 135301734 1 FN8C29H29 AB8C29D29 167.42 9.13 -8.33 -1.81 0
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449812 135301740 1 O2N4C17H26 A2B4C17D26 -81.68 2.35 -8.6 -0.28 0
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449813 135301764 1 FOSN5C19H24 ABCD5E19F24 -40.39 4.02 -8.73 -0.37 0
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449814 135301776 1 N2C17H24 A2B17C24 28.61 1.02 -8.2 0.13 0
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449815 135301780 1 NF3O3C8H12 AB3C3D8E12 -294.69 2.7 -10.23 -0.48 0
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449816 135301802 2 NOC13H25 ABC13D25 -173.19 3.74 -8.94 0.62 0
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449817 135301812 1 N4C13H20 A4B13C20 27.75 3.66 -8.54 -0.08 0