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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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76702 48425265 1 F3N3O3C20H26 A3B3C3D20E26 -272.85 3.86 -8.88 -0.18 0
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76703 48425266 1 F3N3O4C17H30 A3B3C4D17E30 -375.92 5.64 -8.61 0.55 0
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76704 48425267 1 N2F3O3C19H27 A2B3C3D19E27 -283.09 4.04 -8.94 0.24 0
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76705 48425268 1 N2F3O3C19H27 A2B3C3D19E27 -281.49 3.84 -9.01 0.1 0
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76706 48425269 1 N2F3O3C18H25 A2B3C3D18E25 -269.43 2.75 -9.0 0.09 0
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76707 48425270 1 N2F3O4C19H27 A2B3C4D19E27 -309.08 6.57 -8.61 -0.24 0
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76708 48425271 1 N2F3O3C19H27 A2B3C3D19E27 -276.26 2.89 -8.79 0.29 0
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76709 48425272 1 SN2O2F3C19H27 AB2C2D3E19F27 -238.28 5.53 -8.42 0.02 0
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76710 48425273 1 SN2O2F4C17H22 AB2C2D4E17F22 -270.2 4.91 -8.91 -0.79 0
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76711 48425274 1 F3N3O4C19H26 A3B3C4D19E26 -325.01 3.18 -9.02 0.06 0
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76712 48425275 1 N2F3O3C19H27 A2B3C3D19E27 -275.45 5.82 -8.86 0.1 0
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76713 48425276 2 NOF2C10H13 ABC2D10E13 -273.18 3.75 -8.78 -0.26 0
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76714 48425277 1 N2O2F3C21H29 A2B2C3D21E29 -232.48 4.65 -8.76 0.04 0
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76715 48425278 1 N2O2F4C19H24 A2B2C4D19E24 -258.44 4.72 -8.79 -0.13 0
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76716 48425279 1 O2F3N4C15H23 A2B3C4D15E23 -214.45 6.36 -9.12 0.22 0
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76717 48425280 1 F3N3O4C15H26 A3B3C4D15E26 -350.09 1.38 -8.92 0.22 0
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76718 48425281 1 SN2F3O4C13H23 AB2C3D4E13F23 -344.58 3.64 -8.78 0.26 0
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76719 48425283 1 SN2O2F5C17H21 AB2C2D5E17F21 -319.14 5.9 -8.83 -0.94 0
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76720 48425284 1 F3N3O3C19H26 A3B3C3D19E26 -274.85 3.12 -8.81 -0.36 0
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76721 48425285 1 ClSN2O2F3C17H22 ABC2D2E3F17G22 -234.98 6.86 -8.86 -0.52 0
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76722 48425286 1 F3N3O3C14H24 A3B3C3D14E24 -308.95 7.57 -8.83 0.76 0
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76723 48425288 1 SN2O2F3C19H25 AB2C2D3E19F25 -236.75 2.58 -8.34 0.11 0
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76724 48425289 1 F3N3O4C15H22 A3B3C4D15E22 -337.69 2.06 -8.84 0.08 0
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76725 48425290 1 SF3N3O3C18H24 AB3C3D3E18F24 -268.01 6.27 -9.16 -1.01 0
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76726 48425291 1 O2F3N4C20H33 A2B3C4D20E33 -250.2 2.4 -8.73 0.64 0
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76727 48425292 2 NOF3C9H11 ABC3D9E11 -389.58 6.38 -9.15 -0.72 0
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76728 48425293 1 N2O2S2F3C17H29 A2B2C2D3E17F29 -271.72 8.97 -7.96 -0.63 0
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76729 48425294 1 F3N3O3C16H28 A3B3C3D16E28 -317.98 1.99 -9.09 0.56 0
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76730 48425295 1 ClN2O3F4C17H21 AB2C3D4E17F21 -311.09 6.55 -9.1 -0.51 0
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76731 48425298 1 N2O2F4C19H24 A2B2C4D19E24 -259.56 3.33 -8.96 -0.22 0
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76732 48425299 1 F3N3O3C20H24 A3B3C3D20E24 -244.85 4.16 -8.85 -1.15 0
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76733 48425300 1 SN2F3O3C18H25 AB2C3D3E18F25 -277.49 3.71 -8.75 -0.7 0
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76734 48425303 1 F3N3O3C20H24 A3B3C3D20E24 -219.99 3.85 -8.94 -1.0 0
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76735 48425304 1 F3N3O4C17H24 A3B3C4D17E24 -296.5 4.25 -8.84 -0.58 0
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76736 48425306 1 N2F3O4C18H25 A2B3C4D18E25 -303.22 5.53 -8.87 0.08 0
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76737 48425307 1 SN2O2F3C14H25 AB2C2D3E14F25 -261.03 5.36 -8.57 0.46 0
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76738 48425309 1 N2O2F3C16H25 A2B2C3D16E25 -233.43 2.58 -8.65 0.65 0
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76739 48425311 1 O2F3N3C17H24 A2B3C3D17E24 -232.14 4.17 -8.86 0.03 0
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76740 48425312 1 F3N3O3C16H26 A3B3C3D16E26 -302.45 5.43 -9.02 0.61 0
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76741 48425313 1 SO2F3N3C18H22 AB2C3D3E18F22 -192.99 3.09 -9.31 -0.95 0
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76742 48425315 1 F3N3O4C18H30 A3B3C4D18E30 -357.57 5.73 -8.84 0.72 0
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76743 48425317 2 NOC8H12 ABC8D12 -94.49 2.66 -9.53 -0.07 0
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76744 48425320 1 ClO2S2N3C14H16 AB2C2D3E14F16 -32.62 1.51 -9.37 -1.43 0
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76745 48425321 1 SN3O4C9H19 AB3C4D9E19 -185.51 8.47 -9.83 0.36 0
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76746 48425322 1 N3O3C13H25 A3B3C13D25 -166.08 3.79 -9.67 0.7 0
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76747 48425323 1 N3O3C17H31 A3B3C17D31 -175.03 5.59 -9.04 0.7 0
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76748 48425324 2 ON2C7H12 AB2C7D12 -82.03 3.55 -9.12 0.36 0
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76749 48425326 1 BrO2N4C13H21 AB2C4D13E21 -68.72 5.98 -9.14 0.29 0
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76750 48425327 1 F2N3O3C18H25 A2B3C3D18E25 -229.81 3.36 -9.46 -0.67 0
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76751 48425328 1 F3O3N4C19H27 A3B3C4D19E27 -254.55 3.93 -8.81 -0.44 0