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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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195745 78729822 1 SN2O3C19H20 AB2C3D19E20 -33.89 8.07 -8.03 -1.8 1
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195746 78729901 1 N3O4C19H22 A3B4C19D22 -75.16 5.08 0.0 0.0 1
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195747 78730920 1 ClO2N4C21H32 AB2C4D21E32 -93.26 6.76 0.0 0.0 0
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195748 78730921 1 ClO2N4C21H31 AB2C4D21E31 -111.83 8.3 -9.09 0.08 1
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195749 78730922 1 N4O4C23H29 A4B4C23D29 -86.13 9.26 0.0 0.0 0
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195750 78730923 1 N4O4C23H28 A4B4C23D28 -85.93 5.82 -8.69 -1.85 1
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195751 78730924 1 O2N4C22H27 A2B4C22D27 -8.24 12.18 0.0 0.0 0
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195752 78731079 1 O2N5C22H31 A2B5C22D31 -60.28 6.33 -9.33 -0.78 1
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195753 78731080 1 FO2N4C21H32 AB2C4D21E32 -114.44 6.89 0.0 0.0 0
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195754 78731081 1 FO2N4C21H31 AB2C4D21E31 -136.04 6.43 -9.06 -0.46 1
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195755 78731082 1 O3N5C23H36 A3B5C23D36 -119.9 5.85 0.0 0.0 0
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195756 78731355 1 SN2O3C20H20 AB2C3D20E20 -25.95 3.63 -8.43 -1.51 0
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195757 78731552 1 SN3O5H15C18 AB3C5D15E18 -15.46 11.44 -9.03 -1.96 1
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195758 78731924 1 F2O2N3C21H26 A2B2C3D21E26 -114.38 5.3 0.0 0.0 0
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195759 78732110 1 N2O5C21H26 A2B5C21D26 -206.88 6.81 -9.37 -0.4 0
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195760 78732111 1 NO3C22H25 AB3C22D25 -81.14 5.74 -8.83 -0.19 0
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195761 78732353 1 SN2O4C17H22 AB2C4D17E22 -167.25 8.81 -8.87 -0.24 0
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195762 78732354 1 FN2O6H17C19 AB2C6D17E19 -214.54 3.27 -9.1 -0.45 0
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195763 78732355 1 N3O3C19H25 A3B3C19D25 -130.26 9.2 -8.86 -0.24 0
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195764 78732356 1 N3O5C22H23 A3B5C22D23 -103.96 6.17 -8.67 -0.44 0
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195765 78732357 1 FNO4H18C19 ABC4D18E19 -181.42 4.63 -9.29 -0.7 0
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195766 78732358 1 FNO4H20C23 ABC4D20E23 -143.19 3.77 -8.78 -0.47 0
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195767 78732359 1 O2N4H22C23 A2B4C22D23 17.7 4.21 -8.67 -0.83 0
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195768 78732360 1 FNCl2O3H14C17 ABC2D3E14F17 -156.7 3.75 -9.11 -0.7 0
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195769 78732361 1 FNCl2O3H14C17 ABC2D3E14F17 -158.13 4.7 -9.47 -0.67 0
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195770 78732362 1 FNO4H18C19 ABC4D18E19 -179.73 5.29 -9.19 -0.67 0
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195771 78732363 1 FNO3C19H20 ABC3D19E20 -151.77 2.67 -8.65 -0.49 0
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195772 78732364 1 FNO4H22C24 ABC4D22E24 -149.57 1.24 -8.4 -0.42 0
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195773 78732365 1 FN3O4C22H22 AB3C4D22E22 -141.94 1.41 -8.79 -0.52 0
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195774 78732366 1 FON3H20C22 ABC3D20E22 22.08 4.41 -8.84 -0.51 0
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195775 78732367 1 FO2N5C22H24 AB2C5D22E24 -56.43 6.97 -8.98 -0.78 0
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195776 78732368 1 FO2N5C23H26 AB2C5D23E26 -59.56 7.16 -9.14 -0.92 0
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195777 78732369 1 FNO3C20H20 ABC3D20E20 -144.61 4.93 -9.33 -0.24 0
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195778 78732370 1 FO2N5C23H24 AB2C5D23E24 -53.78 5.06 -8.7 -0.72 0
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195779 78732371 1 FO2N4C24H25 AB2C4D24E25 -57.61 7.63 -9.07 -0.9 0
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195780 78732372 1 FNO3H20C23 ABC3D20E23 -110.67 3.02 -8.69 -0.39 0
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195781 78732373 1 ClO2N4C21H25 AB2C4D21E25 -41.7 3.49 -8.41 -0.56 0
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195782 78732374 1 N2F3O3C15H17 A2B3C3D15E17 -288.65 8.02 -8.88 -0.27 0
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195783 78732375 1 FNSO5C20H20 ABCD5E20F20 -213.74 9.35 -9.65 -0.7 0
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195784 78732376 1 O2N5H21C22 A2B5C21D22 32.46 8.2 -8.44 -0.81 0
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195785 78732377 1 FNSO5C20H22 ABCD5E20F22 -229.41 6.1 -9.2 -0.16 0
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195786 78732378 1 N3O5H15C17 A3B5C15D17 -54.21 2.64 -8.74 -2.01 0
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195787 78732379 1 O2N4H22C23 A2B4C22D23 14.45 8.06 -8.4 -0.6 0
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195788 78732380 1 SN2O2H18C19 AB2C2D18E19 -22.22 6.74 -8.51 -0.6 0
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195789 78732381 1 SN4O5C18H22 AB4C5D18E22 -149.6 4.83 -8.68 -0.4 0
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195790 78732382 1 N2O4C21H22 A2B4C21D22 -112.07 5.14 -8.66 -0.37 0
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195791 78732383 1 N2O5C21H22 A2B5C21D22 -159.05 3.69 -8.62 -0.88 0
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195792 78732384 1 N3O6H19C21 A3B6C19D21 -113.69 3.92 -8.54 -1.66 0
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195793 78732385 1 FNO3C18H18 ABC3D18E18 -147.98 3.23 -8.67 -0.49 0
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195794 78732386 2 ON2H10C11 AB2C10D11 19.52 7.28 -8.44 -1.02 1