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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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37228 8018534 1 ClN2O2F3H12C17 AB2C2D3E12F17 -176.95 4.72 -9.43 -1.09 0
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37229 8018535 1 FNO4H16C23 ABC4D16E23 -105.77 2.66 -9.27 -1.47 0
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37230 8018556 1 SO2N4C20H22 AB2C4D20E22 -14.69 8.77 -9.0 -0.67 0
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37231 8018583 1 FNO3H12C17 ABC3D12E17 -84.42 4.71 -10.39 -1.36 1
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37232 8018595 1 BrO2N3C16H25 AB2C3D16E25 -76.66 4.04 0.0 0.0 0
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37233 8018598 1 SN3O3H13C18 AB3C3D13E18 -10.98 6.55 -9.33 -1.88 0
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37234 8018608 1 N2O3H20C23 A2B3C20D23 -28.46 9.09 -8.92 -1.14 0
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37235 8018611 1 SN3O3H17C21 AB3C3D17E21 -21.53 4.19 -8.57 -1.52 0
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37236 8018615 1 SN3O5C19H19 AB3C5D19E19 -123.68 6.82 -9.29 -1.74 0
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37237 8018616 1 N2O3C19H24 A2B3C19D24 -109.52 2.42 -9.8 -1.59 0
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37238 8018617 1 SN2O5C21H24 AB2C5D21E24 -162.48 9.56 -9.35 -0.75 0
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37239 8018619 1 SN2O5C21H24 AB2C5D21E24 -162.24 7.63 -9.23 -0.61 0
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37240 8018676 1 SN2O5C14H18 AB2C5D14E18 -205.23 3.24 -8.63 -0.59 0
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37241 8018681 1 NCl2O2H9C15 AB2C2D9E15 -18.32 2.5 -9.69 -1.51 0
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37242 8018685 1 NO8C15H17 AB8C15D17 -308.67 2.28 -9.48 -1.11 1
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37243 8018690 1 N2O3C19H25 A2B3C19D25 -67.82 1.53 0.0 0.0 0
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37244 8018703 1 SN3O4C21H23 AB3C4D21E23 -19.11 1.19 -8.1 -1.32 1
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37245 8018717 1 SN2O3C19H25 AB2C3D19E25 -54.5 4.28 0.0 0.0 0
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37246 8018718 1 NCl2O4C12H13 AB2C4D12E13 -169.16 5.13 -9.15 -0.6 0
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37247 8018731 1 N2O3C19H24 A2B3C19D24 -98.89 5.81 -9.61 -0.71 0
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37248 8018732 1 N2O3C19H24 A2B3C19D24 -99.08 5.14 -9.49 -0.56 0
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37249 8018736 1 NF2O6C13H13 AB2C6D13E13 -331.37 4.58 -10.12 -1.04 0
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37250 8018749 2 NO2H10C11 AB2C10D11 -65.71 8.59 -8.99 -1.18 0
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37251 8018753 1 SN2O4H16C18 AB2C4D16E18 -49.92 4.14 -8.77 -0.77 0
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37252 8018771 1 FN2O3H15C18 AB2C3D15E18 -87.21 2.93 -9.81 -1.65 0
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37253 8018772 1 N2O4C13H14 A2B4C13D14 -115.88 2.09 -9.48 -0.9 0
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37254 8018781 1 SN2O6H18C20 AB2C6D18E20 -145.28 0.65 -9.54 -1.54 0
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37255 8018782 1 SN2O4C20H20 AB2C4D20E20 -111.31 3.32 -8.71 -0.88 0
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37256 8018810 1 OSF2N2H12C14 ABC2D2E12F14 -64.72 1.22 -9.13 -1.19 0
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37257 8018821 2 NO2C10H12 AB2C10D12 -140.34 2.04 -9.48 -1.13 0
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37258 8018833 1 NO5C19H27 AB5C19D27 -223.1 4.59 -9.27 -0.5 0
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37259 8018842 1 N2O5H20C24 A2B5C20D24 -91.21 3.38 -8.43 -1.48 0
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37260 8018898 1 SN2O4H18C19 AB2C4D18E19 -104.05 5.56 -8.69 -0.88 0
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37261 8018934 1 NCl2O4C13H15 AB2C4D13E15 -171.68 5.59 -9.54 -0.42 0
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37262 8018967 1 ClN2O3H15C18 AB2C3D15E18 -61.28 2.34 -9.7 -1.74 0
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37263 8018969 1 FN3O3C20H24 AB3C3D20E24 -114.85 2.19 -9.28 -0.49 0
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37264 8018971 1 SN4O5H18C19 AB4C5D18E19 -68.36 5.88 -8.93 -1.39 0
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37265 8019014 1 N2O5C16H22 A2B5C16D22 -204.39 5.04 -9.09 -0.55 0
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37266 8019020 1 NO4H17C19 AB4C17D19 -51.12 5.35 -8.42 -1.12 0
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37267 8019023 1 ClON2F3C20H20 ABC2D3E20F20 -177.77 6.55 -9.28 -0.97 0
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37268 8019024 1 NO5C15H19 AB5C15D19 -188.29 4.63 -9.47 -0.07 0
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37269 8019028 1 O5H18C20 A5B18C20 -99.15 4.02 -8.41 -0.96 0
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37270 8019032 1 BrO4H17C18 AB4C17D18 -82.07 6.05 -8.3 -0.84 0
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37271 8019049 1 N2O5C13H16 A2B5C13D16 -193.72 6.72 -8.37 -0.25 0
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37272 8019050 2 NO2C8H12 AB2C8D12 -185.23 2.76 -9.23 -0.23 1
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37273 8019056 1 N2O2C21H29 A2B2C21D29 -40.85 5.05 0.0 0.0 0
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37274 8019057 1 ClNSO3H18C19 ABCD3E18F19 -87.06 2.09 -8.73 -0.6 0
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37275 8019061 1 N2F3O6H11C12 A2B3C6D11E12 -308.98 4.02 -10.28 -1.94 0
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37276 8019064 1 ClON2C23H23 ABC2D23E23 9.52 3.72 -8.88 -0.21 0
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37277 8019066 1 N2O6C15H18 A2B6C15D18 -153.39 10.12 -9.1 -1.14 0
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37278 8019073 1 N2O6C11H12 A2B6C11D12 -147.34 1.58 -9.66 -1.46 0
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37279 8019080 1 SN2O4C20H20 AB2C4D20E20 -107.28 4.5 -8.81 -0.55 0
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37280 8019081 1 NO4C20H21 AB4C20D21 -115.02 5.0 -8.71 -0.39 0
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37281 8019113 1 NO5C16H21 AB5C16D21 -210.73 3.14 -9.52 -0.4 0
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37282 8019114 1 N2O2C15H18 A2B2C15D18 -59.35 4.58 -8.49 -0.04 0
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37283 8019115 1 NO6C22H29 AB6C22D29 -222.61 6.48 -8.57 0.25 0
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37284 8019116 1 N2O5C14H16 A2B5C14D16 -111.54 8.19 -9.46 -1.25 0
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37285 8019139 1 NOC17H19 ABC17D19 2.51 2.92 -8.73 0.04 0
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37286 8019144 1 NO3C20H21 AB3C20D21 -80.78 1.57 -8.64 -0.25 1
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37287 8019153 1 BrON2C13H20 ABC2D13E20 -27.85 4.29 0.0 0.0 0
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37288 8019155 1 NO6C23H25 AB6C23D25 -182.2 4.9 -8.66 -0.58 2
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37289 8019156 1 ON3C17H31 AB3C17D31 -37.52 2.15 -8.75 0.09 0
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37290 8019158 1 NO6C23H25 AB6C23D25 -183.14 5.05 -8.61 -0.43 0
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37291 8019171 1 ON3C20H33 AB3C20D33 -45.67 3.11 -8.68 0.37 0
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37292 8019172 1 NSO6C20H21 ABC6D20E21 -156.12 2.48 -8.68 -0.97 0
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37293 8019180 1 ON3C20H33 AB3C20D33 -49.44 3.39 -8.55 0.31 0
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37294 8019221 4 O2C5H6 A2B5C6 -291.49 2.28 -8.44 -0.24 0
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37295 8019238 1 FO6C20H23 AB6C20D23 -247.78 1.32 -8.72 -0.11 0
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37296 8019244 1 ClN2O2H19C20 AB2C2D19E20 -30.79 3.0 -8.52 -0.42 0
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37297 8019245 2 O4C11H11 A4B11C11 -272.71 7.3 -8.88 -1.16 0
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37298 8019253 1 NO6C20H29 AB6C20D29 -252.45 4.99 -8.78 0.03 0
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37299 8019263 1 NO6C24H31 AB6C24D31 -229.31 3.02 -8.6 -0.06 0
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37300 8019302 2 NO3C11H15 AB3C11D15 -224.79 7.02 -8.91 -0.06 1
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37301 8019306 1 BrO2N3C20H21 AB2C3D20E21 23.74 3.97 0.0 0.0 1
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37302 8019313 1 SN3O5C19H30 AB3C5D19E30 -167.45 6.93 0.0 0.0 0