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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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340696 127262707 1 NPC36H42 ABC36D42 50.74 3.19 -8.07 0.12 0
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340697 127262708 1 NPH32C38 ABC32D38 147.44 1.44 -8.09 -0.03 0
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340698 127262709 1 NOPH28C36 ABCD28E36 95.21 4.82 -8.41 -0.37 0
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340699 127262710 1 KNPC25H25 ABCD25E25 28.82 8.12 -6.44 0.05 0
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340700 127262711 1 NOPC30H42 ABCD30E42 -45.1 1.03 -8.17 0.24 0
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340701 127262712 1 OPC28H33 ABC28D33 -44.78 4.66 -8.57 -0.24 0
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340702 127262713 1 PSC28H33 ABC28D33 -19.6 5.79 -8.0 -0.22 0
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340703 127262714 1 ClNPO4H25C26 ABCD4E25F26 66.02 14.36 -8.26 -1.94 0
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340704 127262715 1 INPC25H41 ABCD25E41 -60.35 13.82 -6.89 0.08 1
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340705 127262716 1 NPC25H41 ABC25D41 -34.14 3.66 0.0 0.0 0
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340706 127262717 1 INPH25C26 ABCD25E26 121.09 25.29 -5.78 -1.28 0
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340707 127262718 1 NOPH30C33 ABCD30E33 44.81 6.91 -8.41 0.06 0
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340708 127262719 2 OPC18H26 ABC18D26 -179.85 1.68 -8.95 0.32 0
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340709 127262720 1 NPC32H46 ABC32D46 -22.61 2.54 -8.15 0.1 0
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340710 127262721 1 NPH32C36 ABC32D36 136.38 3.94 -7.33 -0.71 0
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340711 127262722 1 NPH32C36 ABC32D36 108.0 1.46 -8.15 -0.38 0
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340712 127262723 1 PO2C24H31 AB2C24D31 -109.76 3.77 -9.34 -0.22 0
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340713 127262724 1 OPC24H29 ABC24D29 -29.06 1.97 -8.34 0.22 0
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340714 127262725 1 PH29C30 AB29C30 67.31 1.21 -8.73 -0.14 0
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340715 127262726 1 BrPC30H34 ABC30D34 22.67 1.27 -8.25 0.08 0
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340716 127262727 2 PC21H22 AB21C22 74.58 1.01 -8.21 -0.3 0
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340717 127262728 2 PC21H28 AB21C28 -19.82 1.76 -8.0 -0.12 0
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340718 127262729 1 ClP2C36H51 AB2C36D51 -47.13 0.51 -8.07 -0.1 0
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340719 127262730 1 PN2C33H51 AB2C33D51 -30.8 2.27 -8.1 0.31 0
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340720 127262731 1 NPC26H44 ABC26D44 -70.66 1.34 -7.92 0.65 0
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340721 127262732 1 PC34H51 AB34C51 -58.12 0.55 -8.07 0.43 0
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340722 127262733 1 ClNPC27H27 ABCD27E27 66.86 12.43 -7.38 -0.83 1
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340723 127262734 1 NPC27H27 ABC27D27 102.7 8.52 0.0 0.0 0
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340724 127262735 1 BrNPC27H27 ABCD27E27 78.71 16.78 -5.57 -0.92 0
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340725 127262736 1 BrNPC25H41 ABCD25E41 -73.13 12.73 -7.46 0.28 1
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340726 127262737 1 NPC25H41 ABC25D41 -32.19 3.06 0.0 0.0 0
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340727 127262738 1 INPC27H27 ABCD27E27 84.68 12.64 -6.46 -0.94 0
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340728 127262739 1 OP2C38H56 AB2C38D56 -102.14 2.84 -8.16 0.21 0
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340729 127262740 1 NOPC36H40 ABCD36E40 -24.86 3.86 -8.31 0.31 0
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340730 127262741 2 NPH19C20 ABC19D20 141.18 3.45 -8.06 0.16 0
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340731 127262742 1 PN2C25H29 AB2C25D29 49.45 2.82 -8.53 0.06 0
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340732 127262743 1 NPC27H32 ABC27D32 41.03 2.3 -8.48 0.11 0
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340733 127262744 1 NPC25H38 ABC25D38 -15.85 0.65 -7.98 0.5 0
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340734 127262745 1 NPC19H24 ABC19D24 4.93 1.83 -8.1 0.29 0
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340735 127262746 1 NOPC21H30 ABCD21E30 -37.16 4.13 -8.47 -0.26 0
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340736 127262747 1 PC22H29 AB22C29 0.64 1.21 -8.17 0.36 0
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340737 127262748 1 NOPH32C34 ABCD32E34 30.23 2.4 -7.82 -0.12 0
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340738 127262749 1 NPC20H32 ABC20D32 -23.74 0.76 -8.22 0.31 0
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340739 127262750 1 ClP2C36H39 AB2C36D39 40.68 2.11 -8.29 -0.06 0
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340740 127262751 1 NPC26H36 ABC26D36 -41.23 0.83 -8.17 0.44 0
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340741 127262752 1 NOPC40H44 ABCD40E44 23.48 0.84 -7.84 -0.57 0
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340742 127262753 1 NPSF3O3H27C28 ABCD3E3F27G28 -224.16 11.12 -8.45 -0.47 1
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340743 127262754 1 NPC27H27 ABC27D27 81.99 8.0 0.0 0.0 0
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340744 127262755 1 NPC37H48 ABC37D48 -23.75 1.62 -7.9 0.38 0
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340745 127262756 1 NP2C41H59 AB2C41D59 -34.03 2.54 -7.86 0.1 0
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340746 127262757 1 NPC34H48 ABC34D48 -20.88 3.12 -8.16 -0.36 0
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340747 127262758 1 NPO2C28H28 ABC2D28E28 15.17 2.73 -8.01 0.33 0
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340748 127262759 2 PO2C29H34 AB2C29D34 -105.91 2.98 -8.01 0.08 0
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340749 127262760 1 PO2C47H57 AB2C47D57 -26.08 4.31 -7.87 0.16 0
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340750 127262761 1 OPC40H43 ABC40D43 2.08 0.42 -7.73 -0.58 0
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340751 127262762 1 PO2C46H55 AB2C46D55 -88.18 2.61 -8.4 -0.42 0
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340752 127262763 1 OPC41H45 ABC41D45 -4.16 0.98 -8.06 -0.39 0
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340753 127262764 1 PO2C25H37 AB2C25D37 -107.19 3.62 -8.17 0.16 0
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340754 127262765 1 PO2C32H51 AB2C32D51 -130.57 3.26 -7.76 0.22 0
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340755 127262766 1 OPF3C34H48 ABC3D34E48 -262.52 2.13 -8.18 -0.1 0
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340756 127262767 1 OPC40H61 ABC40D61 -105.94 1.86 -7.71 0.4 0
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340757 127262769 1 PO2C27H41 AB2C27D41 -114.11 2.24 -7.98 0.2 0
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340758 127262770 1 PO2C29H45 AB2C29D45 -117.57 3.54 -8.02 0.2 0
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340759 127262771 1 PO2C33H53 AB2C33D53 -136.36 1.38 -7.47 0.27 0
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340760 127262772 1 PO2C31H43 AB2C31D43 -82.38 4.74 -7.79 0.04 0
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340761 127262773 1 PO2C40H43 AB2C40D43 -57.08 3.36 -8.39 -0.42 0
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340762 127262774 1 PO2C41H45 AB2C41D45 -62.45 2.97 -8.24 -0.42 0
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340763 127262775 2 OPC35H40 ABC35D40 -8.06 3.19 -7.94 0.28 0
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340764 127262776 1 PC37H57 AB37C57 -82.2 1.75 -7.82 0.61 0
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340765 127262777 1 PO2C28H43 AB2C28D43 -109.65 4.02 -7.8 0.16 0
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340766 127262778 1 PO4C35H41 AB4C35D41 -136.63 2.55 -8.1 -0.51 0
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340767 127262779 1 PO2C34H55 AB2C34D55 -135.21 3.21 -7.73 0.24 0
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340768 127262780 1 PO2C33H53 AB2C33D53 -138.99 1.02 -7.7 0.25 0
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340769 127262781 1 PO2C37H53 AB2C37D53 -105.17 4.11 -7.69 0.46 0
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340770 127262782 1 PO4C31H39 AB4C31D39 -153.17 3.73 -8.59 -0.7 0