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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179684 76519213 1 NSNa2O6H11C20 ABC2D6E11F20 -244.55 18.06 -9.43 -2.55 -1
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179685 76519214 1 N5O6C31H38 A5B6C31D38 -192.9 5.88 0.0 0.0 0
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179686 76519215 1 SN3O8H21C23 AB3C8D21E23 -103.29 7.49 -9.25 -1.26 0
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179687 76519216 1 SN2O4C8H16 AB2C4D8E16 -131.71 5.8 -8.23 -0.22 0
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179688 76519437 1 NS2O4C15H23 AB2C4D15E23 -174.63 5.27 -9.03 -0.43 0
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179689 76519592 1 N2F5O5C17H17 A2B5C5D17E17 -438.45 4.94 -10.47 -1.11 0
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179690 76519817 1 N3O6C32H49 A3B6C32D49 -290.85 2.49 -9.36 0.16 -1
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179691 76519844 1 ClNO4C25H45 ABC4D25E45 -147.37 7.77 0.0 0.0 -1
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179692 76519851 1 ClNO4C13H25 ABC4D13E25 -164.57 8.17 0.0 0.0 0
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179693 76519877 1 PN2O7C26H47 AB2C7D26E47 -438.34 6.43 -10.22 -0.13 -1
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179694 76519878 1 PN3O7C29H49 AB3C7D29E49 -342.07 6.58 0.0 0.0 -1
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179695 76519994 1 SN4O10C36H51 AB4C10D36E51 -368.67 2.02 0.0 0.0 0
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179696 76519995 1 SN4O10C36H52 AB4C10D36E52 -403.55 13.54 -9.4 -1.2 -1
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179697 76520131 1 ClO4N5C37H41 AB4C5D37E41 -81.98 9.43 0.0 0.0 0
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179698 76520132 1 ClO4N5C37H42 AB4C5D37E42 -112.51 4.89 -8.6 -0.32 0
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179699 76520133 1 ClN2O3H7C11 AB2C3D7E11 -42.92 2.52 -10.08 -2.2 0
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179700 76520139 1 ClOSiC10H19 ABCD10E19 -88.05 4.45 -7.66 0.27 0
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179701 76520140 1 ClOSiC11H21 ABCD11E21 -93.33 4.47 -7.63 0.29 -2
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179702 76520141 1 ClPN3O8C26H29 ABC3D8E26F29 -299.17 4.75 -10.19 -2.12 0
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179703 76520142 1 ClPN3O8C26H31 ABC3D8E26F31 -365.37 8.13 -9.96 -2.09 -2
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179704 76520143 1 ClPN4O9C20H26 ABC4D9E20F26 -286.84 4.64 -10.4 -1.78 0
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179705 76520144 1 ClPN4O9C20H28 ABC4D9E20F28 -353.46 4.63 -10.22 -1.46 -1
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179706 76520145 1 ClO2N5C17H17 AB2C5D17E17 -7.08 7.59 0.0 0.0 0
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179707 76520146 1 ClO2N5C17H18 AB2C5D17E18 -33.12 6.95 -8.66 -0.69 0
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179708 76520147 1 ClC4H4N5 AB4C4D5 93.57 7.44 -9.75 -1.35 -1
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179709 76520148 1 SN2O3C18H23 AB2C3D18E23 -79.15 0.99 0.0 0.0 0
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179710 76520149 1 SN2O3C18H24 AB2C3D18E24 -100.8 3.34 -9.11 -0.07 -1
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179711 76520211 1 N3O6C31H46 A3B6C31D46 -245.82 7.32 0.0 0.0 -1
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179712 76520265 1 NO6C16H16 AB6C16D16 -199.94 3.41 0.0 0.0 0
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179713 76520292 1 INO5C14H22 ABC5D14E22 -211.06 2.05 -8.32 -0.71 -1
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179714 76520606 1 SN4O8C32H41 AB4C8D32E41 -253.2 12.4 0.0 0.0 -1
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179715 76521455 1 N4O6C32H41 A4B6C32D41 -198.69 5.17 0.0 0.0 -1
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179716 76521495 1 N3O7C30H42 A3B7C30D42 -280.57 3.42 0.0 0.0 0
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179717 76521612 1 FOC22H25 ABC22D25 -72.25 3.38 -8.86 -0.53 0
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179718 76522048 2 O5C15H23 A5B15C23 -506.64 5.22 -10.0 0.55 2
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179720 76522300 2 NOC14H14 ABC14D14 -4.75 6.34 -9.15 -0.77 0
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179721 76522310 1 NSiO4C27H43 ABC4D27E43 -245.92 5.28 -9.34 -0.08 -1
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179722 76522311 1 N2O4C11H17 A2B4C11D17 -142.72 2.51 0.0 0.0 0
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179723 76522312 1 N2O4C11H18 A2B4C11D18 -170.92 5.46 -9.72 -0.01 -1
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179724 76522313 1 NF2O3C23H24 AB2C3D23E24 -124.4 6.02 0.0 0.0 0
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179725 76522314 1 NF2O3C23H25 AB2C3D23E25 -155.38 7.08 -9.55 -0.49 -1
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179726 76522315 1 NO4C17H20 AB4C17D20 -114.34 5.6 0.0 0.0 0
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179727 76522316 1 NO4C17H21 AB4C17D21 -142.66 8.15 -9.7 -0.97 -1
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179728 76522317 1 SN3O3C12H16 AB3C3D12E16 -86.53 5.86 0.0 0.0 0
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179729 76522318 1 SN3O3C12H17 AB3C3D12E17 -110.21 4.13 -9.19 -0.72 -1
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179730 76522319 1 ClN2O3C16H20 AB2C3D16E20 -100.37 6.49 0.0 0.0 0
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179731 76522320 1 ClN2O3C16H21 AB2C3D16E21 -135.08 4.55 -9.74 -0.49 -1
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179732 76522321 1 NO3C12H18 AB3C12D18 -73.83 5.42 0.0 0.0 0
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179733 76522322 1 NO3C12H19 AB3C12D19 -105.41 7.19 -9.64 0.08 -1
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179734 76522323 1 N3O7C19H26 A3B7C19D26 -182.97 7.36 0.0 0.0 0