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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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437232 135216469 1 FO3N5C32H32 AB3C5D32E32 -60.65 1.94 -9.0 -1.03 0
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437233 135216471 1 ClN3C20H26 AB3C20D26 20.79 7.21 -8.79 -0.5 0
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437234 135216472 1 FN3O3C29H34 AB3C3D29E34 -127.07 4.86 -8.89 -0.59 0
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437235 135216474 1 N2O3C29H34 A2B3C29D34 -83.63 5.69 -8.78 -0.27 0
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437236 135216606 1 FO2N4C28H33 AB2C4D28E33 -55.0 5.85 -8.85 -0.73 0
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437237 135216610 1 FO3N6C25H33 AB3C6D25E33 -118.06 5.6 -8.59 -0.52 0
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437238 135216614 1 O2N3C25H35 A2B3C25D35 -85.6 8.33 -9.5 -0.58 0
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437239 135216744 1 ClN3O3C28H32 AB3C3D28E32 -81.61 4.12 -8.89 -0.67 0
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437240 135216746 1 ClFN3O3C28H31 ABC3D3E28F31 -128.9 4.92 -9.08 -0.69 0
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437241 135216749 1 FO2N3C25H34 AB2C3D25E34 -102.5 2.33 -8.67 -0.51 0
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437242 135216886 1 NO3C25H45 AB3C25D45 -134.05 5.7 -9.29 0.95 0
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437243 135216887 1 NC16H25 AB16C25 0.19 1.75 -9.48 0.0 0
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437244 135216890 1 INO6C16H34 ABC6D16E34 -252.28 1.86 -8.99 -1.62 0
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437245 135217434 1 O3N4C24H28 A3B4C24D28 -65.38 5.04 -8.53 -0.6 0
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437246 135217953 1 ClO3N6H13C17 AB3C6D13E17 14.13 8.75 -9.36 -1.67 0
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437247 135218056 1 N9O23C70H91 A9B23C70D91 -842.3 15.05 -8.48 -1.83 0
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437248 135218164 1 NC26H41 AB26C41 -43.13 1.96 -9.13 1.42 0
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437249 135218273 1 O3C10H12 A3B10C12 -115.88 6.01 -10.49 -0.22 0
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437250 135218276 1 ClO2N6C22H23 AB2C6D22E23 20.9 10.88 -9.26 -1.5 0
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437251 135218277 1 ClO2N7C24H26 AB2C7D24E26 0.64 13.7 -8.4 -0.86 0
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437252 135218278 1 ClO2N6H25C29 AB2C6D25E29 47.73 4.7 -9.17 -1.56 0
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437253 135218380 1 N2C61H76 A2B61C76 97.61 4.42 -8.4 0.55 0
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437254 135218666 1 ClN6C12H13 AB6C12D13 92.84 4.41 -8.49 -1.08 0
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437255 135219171 1 BrF2S3N4O4C31H49 AB2C3D4E4F31G49 -175.97 10.56 -7.34 -0.16 0
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437256 135219208 1 OF2N4H30C31 AB2C4D30E31 -58.94 2.77 -8.8 -0.42 0
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437257 135219211 1 F2O2N3H27C36 A2B2C3D27E36 -46.29 6.99 -9.26 -0.6 0
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437258 135219302 1 N3O4H21C26 A3B4C21D26 -43.61 4.2 -8.15 -2.54 0
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437259 135219410 1 OCl2N3C4H7 AB2C3D4E7 -7.04 2.43 -8.67 -0.43 0
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437260 135219473 1 SC36H58 AB36C58 -21.7 2.01 -8.75 0.68 0
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437261 135220178 1 NO4C5H7 AB4C5D7 -155.16 4.19 -10.05 -0.73 0
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437262 135220347 1 O3N7C27H35 A3B7C27D35 -83.72 3.16 -8.17 -0.74 0
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437263 135220377 1 NC12H23 AB12C23 -22.1 1.75 -8.3 1.41 0
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437264 135220394 1 OSN4C32H34 ABC4D32E34 90.49 3.89 -8.14 -0.84 0
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437265 135220434 1 O2N7C23H31 A2B7C23D31 -20.26 6.53 -8.6 -0.54 0
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437266 135220459 1 NO2C16H17 AB2C16D17 -51.21 6.0 -9.17 -0.95 0
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437267 135220475 1 FSN3O3C11H12 ABC3D3E11F12 -108.02 7.31 -9.12 -0.75 0
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437268 135220606 1 FO2N4H19C20 AB2C4D19E20 -42.33 6.07 -8.86 -0.19 0
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437269 135220684 1 O3N4C20H28 A3B4C20D28 -121.23 5.91 -8.76 -0.48 0
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437270 135220685 1 F2O2N5H17C23 A2B2C5D17E23 -29.48 10.53 -9.13 -1.03 0
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437271 135220716 1 FO2N4H17C19 AB2C4D17E19 -39.5 5.85 -8.93 -0.24 0
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437272 135220806 1 SO4N6C26H36 AB4C6D26E36 -72.21 5.83 -8.39 -0.76 1
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437273 135220855 1 ClO2N8C23H28 AB2C8D23E28 166.19 10.39 0.0 0.0 0
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437274 135221049 1 NS2O8C11H13 AB2C8D11E13 -274.72 8.45 -10.79 -1.54 0
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437275 135221101 1 CaO5C6H8 AB5C6D8 -273.74 6.2 -9.24 0.17 0
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437276 135221106 1 MgO5C6H10 AB5C6D10 -237.78 10.43 -7.06 -0.65 0
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437277 135221186 1 ClNO3H14C18 ABC3D14E18 -64.44 4.23 -9.31 -1.2 0
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437278 135221301 1 LiC3N3S3H5 AB3C3D3E5 26.88 9.37 0.0 0.0 0
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437279 135221332 1 ClISN5H11C13 ABCD5E11F13 143.3 4.68 -7.99 -2.02 0
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437280 135221333 1 ISF3N5H11C14 ABC3D5E11F14 -25.25 15.2 -7.69 -1.82 0
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437281 135221364 1 O3N5C11H13 A3B5C11D13 19.16 4.68 -8.94 -1.18 0