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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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194245 78503458 1 FOSN4C20H21 ABCD4E20F21 22.79 4.9 -9.28 -1.04 0
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194246 78503654 1 ClN2O5C21H21 AB2C5D21E21 -182.4 4.12 -9.42 -0.95 0
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194247 78503655 1 ClN3O4H18C20 AB3C4D18E20 -104.23 6.65 -9.48 -0.68 0
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194248 78503656 1 NCl2O5H17C19 AB2C5D17E19 -169.98 4.91 -9.43 -0.92 0
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194249 78503657 1 ClFNO5H17C19 ABCD5E17F19 -205.97 4.93 -9.55 -0.95 0
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194250 78503658 1 ClN4O4C18H21 AB4C4D18E21 -130.8 5.22 -8.32 -1.0 0
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194251 78503659 1 ClSN2O3H19C20 ABC2D3E19F20 -62.86 3.2 -8.5 -1.02 0
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194252 78503660 2 NO2C9H9 AB2C9D9 -123.52 6.86 -9.99 -0.66 0
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194253 78503661 1 BrNO6C25H28 ABC6D25E28 -212.76 5.16 -8.83 -0.75 0
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194254 78503674 1 BrSN2O2C18H21 ABC2D2E18F21 -10.72 5.8 -8.99 -0.86 0
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194255 78504328 1 BrNO4C18H18 ABC4D18E18 -89.39 4.64 -8.92 -1.09 1
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194256 78504392 1 O2N3C22H32 A2B3C22D32 -39.05 4.62 0.0 0.0 1
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194257 78504484 1 O2N3C24H34 A2B3C24D34 -11.08 15.66 0.0 0.0 0
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194258 78504544 1 FSN3O6C15H18 ABC3D6E15F18 -278.74 3.12 -9.92 -0.78 0
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194259 78504545 1 NSO4C18H21 ABC4D18E21 -135.76 7.07 -9.68 -0.5 0
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194260 78504654 2 NO2C11H13 AB2C11D13 -121.21 5.79 -8.22 -0.03 0
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194261 78504763 1 ClNO5H18C21 ABC5D18E21 -166.28 6.68 -9.41 -1.01 0
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194262 78504764 1 ClNO5H20C22 ABC5D20E22 -172.96 8.21 -9.22 -0.99 0
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194263 78505475 1 FN2O4C21H23 AB2C4D21E23 -192.12 4.21 -9.21 -0.45 0
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194264 78505476 1 N3O5C23H27 A3B5C23D27 -197.36 7.13 -8.73 -0.26 0
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194265 78505477 1 ClN2O4C22H25 AB2C4D22E25 -162.45 6.39 -8.86 -0.42 -1
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194266 78505920 1 SN2O3H17C19 AB2C3D17E19 -28.9 1.62 0.0 0.0 0
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194267 78506178 1 N3O3C21H25 A3B3C21D25 -58.84 5.07 -8.96 -0.02 0
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194268 78506179 1 SCl2O2N4C11H12 AB2C2D4E11F12 -49.56 3.8 -9.12 -0.68 0
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194269 78506617 1 BrOSN3H12C14 ABCD3E12F14 54.54 3.44 -9.7 -1.8 0
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194270 78506905 1 OSN3C22H25 ABC3D22E25 37.39 2.43 -8.75 -0.78 0
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194271 78506944 1 N2O5C12H14 A2B5C12D14 -179.24 5.93 -9.54 0.11 0
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194272 78507101 1 N4O5C18H18 A4B5C18D18 -96.71 4.94 -9.86 -1.3 0
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194273 78507640 1 NO6C17H17 AB6C17D17 -116.04 5.25 -9.27 -1.35 0
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194274 78507645 2 N2O2H10C11 A2B2C10D11 -57.82 5.29 -9.51 -1.14 0
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194275 78508778 1 ClN3O3C19H22 AB3C3D19E22 -98.32 6.81 -8.81 -0.51 0
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194276 78508779 1 ClN3O4C19H22 AB3C4D19E22 -124.81 6.4 -9.02 -0.34 1
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194277 78508780 1 ClN3O3C19H23 AB3C3D19E23 -71.36 9.11 0.0 0.0 0
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194278 78509102 1 ClN3O5C10H10 AB3C5D10E10 -120.83 6.93 -10.16 -1.93 2
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194279 78509385 1 N2O4C19H32 A2B4C19D32 -162.22 5.29 -8.71 -0.82 2
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194280 78509386 1 OSN4C20H24 ABC4D20E24 44.28 1.37 -8.67 -0.51 0
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194281 78510064 1 S2N3O3C20H29 A2B3C3D20E29 -103.5 6.59 -9.05 -1.36 0
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194282 78510652 1 N3O5H15C19 A3B5C15D19 -13.54 3.02 -9.69 -1.71 0
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194283 78510653 1 N2O5C21H22 A2B5C21D22 -82.36 4.63 -9.13 -1.57 0
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194284 78510654 1 N2O5H12C14 A2B5C12D14 -35.87 4.91 -10.06 -1.74 0
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194285 78510655 1 N3O6C18H19 A3B6C18D19 -85.39 9.77 -9.24 -1.95 0
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194286 78510656 1 SN2O5H18C19 AB2C5D18E19 -65.88 8.13 -8.76 -1.79 0
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194287 78510657 1 ClO7C21H21 AB7C21D21 -217.66 4.41 -8.84 -0.9 0
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194288 78510658 1 NSO6C20H23 ABC6D20E23 -179.86 6.69 -8.95 -0.96 0
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194289 78510659 1 SO6C20H22 AB6C20D22 -179.68 3.46 -8.57 -0.71 0
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194290 78510660 1 NO6C24H29 AB6C24D29 -190.3 4.67 -8.66 -0.61 0
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194291 78510661 1 N2O7C21H26 A2B7C21D26 -192.69 7.53 -8.69 -1.26 0
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194292 78510863 1 ClN2O2S2C18H21 AB2C2D2E18F21 -60.88 6.91 -8.78 -0.73 0
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194293 78510864 1 SN4O4C20H22 AB4C4D20E22 -114.66 8.48 -9.26 -1.1 0
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194294 78511379 1 N2O3C17H18 A2B3C17D18 -8.06 10.63 -9.05 -1.39 0