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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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184545 77174805 1 ClO2N3C10H14 AB2C3D10E14 -87.86 3.5 -8.58 -0.6 0
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184546 77174806 1 ClN3O4C10H12 AB3C4D10E12 -89.67 2.12 -10.09 -1.8 0
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184547 77174807 1 ClO2H7C10 AB2C7D10 -36.96 2.07 -9.47 -0.96 0
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184548 77174846 1 NCl2O4C12H15 AB2C4D12E15 -93.65 3.37 -9.32 -1.39 0
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184549 77174975 1 N4O4C9H14 A4B4C9D14 -132.45 3.55 -10.07 -0.71 0
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184550 77174976 1 FON2C18H23 ABC2D18E23 -36.01 2.73 -9.41 -0.13 0
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184551 77175037 1 SO5N6C26H30 AB5C6D26E30 -78.36 4.27 -8.68 -1.03 0
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184552 77175055 1 O2N3H13C14 A2B3C13D14 -6.75 1.78 -8.51 -0.33 0
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184553 77175143 1 SN2O4C19H26 AB2C4D19E26 -174.21 4.73 -8.99 -0.31 0
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184554 77175144 2 N3O3C17H22 A3B3C17D22 -180.59 2.61 -9.08 -0.83 0
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184555 77175145 6 NOC6H7 ABC6D7 -166.92 3.22 -9.19 -0.94 0
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184556 77175146 1 ClO2N4H11C12 AB2C4D11E12 -7.03 0.73 -8.96 -0.71 0
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184557 77175148 1 N2C11H18 A2B11C18 15.38 2.41 -8.98 0.55 0
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184558 77175149 1 O4N5C12H13 A4B5C12D13 -71.4 6.95 -9.2 -1.07 0
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184559 77175150 1 ClNO5C20H26 ABC5D20E26 -232.44 6.36 -8.9 -0.14 0
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184560 77175151 1 ClSO3N4C14H15 ABC3D4E14F15 -58.74 5.22 -8.75 -0.43 0
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184561 77175152 1 NO4H13C14 AB4C13D14 -99.19 4.23 -10.12 -2.29 0
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184562 77175322 1 NOC15H15 ABC15D15 19.05 1.9 -8.64 -0.18 0
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184563 77175323 1 N2O4C15H22 A2B4C15D22 -178.0 4.0 -9.64 0.02 0
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184564 77175428 1 O4C15H18 A4B15C18 -156.83 7.06 -10.11 -0.58 0
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184565 77175658 1 NO3C17H25 AB3C17D25 -136.42 2.06 -8.97 -0.06 0
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184566 77175906 1 SF3O3N4C20H29 AB3C3D4E20F29 -266.26 7.11 -8.7 -1.0 0
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184567 77176531 1 Cl2N2O3C16H18 A2B2C3D16E18 -115.83 5.33 -9.09 -0.38 0
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184568 77176615 1 Cl2N2O3C17H20 A2B2C3D17E20 -130.52 3.85 -9.53 -0.71 0
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184569 77176860 1 N3O4C21H21 A3B4C21D21 -111.31 2.3 -8.7 -1.36 0
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184570 77176861 1 ClO2N3C18H20 AB2C3D18E20 -70.35 3.51 -8.44 -0.3 1
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184571 77177516 1 NPO7C20H35 ABC7D20E35 -365.65 4.05 0.0 0.0 0
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184572 77178053 1 ClFO2H22C24 ABC2D22E24 -92.65 4.07 -9.11 -0.48 0
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184573 77178644 1 N4O4C27H32 A4B4C27D32 -85.88 2.66 -8.56 -0.92 0
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184574 77178645 1 ClN3O3C8H12 AB3C3D8E12 -106.38 6.82 -10.22 -1.39 0
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184575 77178646 1 N3O3C31H39 A3B3C31D39 -61.12 7.32 -8.78 -0.73 0
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184576 77178647 1 N3O4C33H41 A3B4C33D41 -101.04 3.12 -8.84 -0.93 0
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184577 77178648 1 PO6N8C9H17 AB6C8D9E17 -130.9 12.89 -8.62 -1.62 0
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184578 77178763 2 OC11H13 AB11C13 -74.25 2.1 -8.86 0.41 0
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184579 77178867 1 SN4O4C32H46 AB4C4D32E46 -141.76 7.39 -8.06 -0.61 0
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184580 77178990 1 FNOC15H20 ABCD15E20 -79.07 3.13 -8.76 -0.01 0
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184581 77179005 1 SiO4C17H32 AB4C17D32 -270.67 4.67 -9.05 0.61 0
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184582 77179109 1 F3O3N7C31H38 A3B3C7D31E38 -182.15 6.5 -9.12 -1.06 0
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184583 77179198 1 F2O2N7C27H35 A2B2C7D27E35 -54.05 5.84 -8.99 -0.55 0
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184584 77179361 1 FO3N8C24H31 AB3C8D24E31 -44.94 3.82 -8.57 -1.13 0
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184585 77179754 1 F2O4N5C23H23 A2B4C5D23E23 -100.88 5.85 -8.74 -0.86 0
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184586 77179863 1 O3N7C20H29 A3B7C20D29 -22.83 3.58 -8.58 -0.72 0
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184587 77179914 1 SO3N5C18H31 AB3C5D18E31 -106.08 3.73 -8.38 -0.36 0
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184588 77179986 1 O3N7C29H37 A3B7C29D37 47.26 8.69 -9.02 -2.17 0
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184589 77180254 1 SiN2O6C34H50 AB2C6D34E50 -304.92 2.49 -9.22 0.11 0
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184590 77180255 1 N2O4C17H24 A2B4C17D24 -173.76 3.19 -9.39 0.29 0
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184591 77180256 1 SN4O4C34H40 AB4C4D34E40 -78.36 6.38 -9.25 -0.57 0
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184592 77180576 1 NCl2F3O5H20C24 AB2C3D5E20F24 -303.73 5.27 -9.82 -1.25 0
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184593 77180604 2 NO2C7H9 AB2C7D9 -116.96 8.83 -9.86 -0.55 0
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184594 77181456 1 SO2F5N5H20C22 AB2C5D5E20F22 -224.25 7.22 -9.22 -2.15 0