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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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424205 135121734 1 O2F3H9C10 A2B3C9D10 -217.28 3.48 -10.3 -0.72 0
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424206 135121737 1 Cl2N2C9H14 A2B2C9D14 -42.05 5.89 -9.22 -0.24 0
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424207 135121739 1 ISH2F3C5 ABC2D3E5 -116.06 3.34 -9.56 -1.55 0
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424208 135121743 1 ClN2C9H15 AB2C9D15 -18.3 1.23 -8.64 0.13 1
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424209 135121744 1 NNaI4O5H13C15 ABC4D5E13F15 -164.82 11.21 0.0 0.0 0
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424210 135121747 1 ClON2F3H8C10 ABC2D3E8F10 -156.97 5.52 -9.6 -0.8 0
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424211 135121750 2 ClNOC7H8 ABCD7E8 -106.06 4.02 -9.91 -1.1 1
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424212 135121752 1 NNaO5C7H11 ABC5D7E11 -247.39 6.25 0.0 0.0 -2
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424213 135121753 1 Na2P3N5C10H14O14 A2B3C5D10E14F14 -775.85 25.65 -8.96 -1.77 0
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424214 135121754 2 NOC9H13 ABC9D13 -48.63 1.14 -8.58 0.16 0
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424215 135121758 1 N3C13H13 A3B13C13 104.1 1.1 -8.66 -0.13 0
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424216 135121759 1 ON5C14H15 AB5C14D15 64.8 3.47 -8.85 -0.93 0
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424217 135121760 1 Cl2N3H9C13 A2B3C9D13 84.9 3.74 -9.45 -0.9 0
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424218 135121762 1 BrNO2C14H14 ABC2D14E14 -45.37 2.28 -8.3 -0.36 0
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424219 135121766 1 N5C20H27 A5B20C27 73.44 2.91 -9.07 -0.62 0
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424220 135121789 1 INO2C11H20 ABC2D11E20 -67.59 11.16 -7.45 -1.56 0
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424221 135121791 1 IN3O3C16H26 AB3C3D16E26 -98.19 16.61 -7.08 -1.05 0
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424222 135121795 1 BrNO2C22H26 ABC2D22E26 -2.74 13.64 -7.91 -1.23 0
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424223 135121796 2 INOC14H22 ABCD14E22 -34.69 11.07 -7.35 -0.46 0
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424224 135121812 1 BrNO4C13H26 ABC4D13E26 -212.57 11.48 -7.88 0.08 0
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424225 135121814 2 ClON2C6H14 ABC2D6E14 -147.74 5.18 -8.76 -0.18 2
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424226 135121815 2 ON2C6H14 AB2C6D14 -58.97 13.48 -7.67 -0.41 0
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424227 135121824 1 IN3O3C16H26 AB3C3D16E26 -110.98 5.25 -7.72 -0.14 0
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424228 135121832 2 INOC13H20 ABCD13E20 7.79 22.11 -6.6 -0.76 0
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424229 135121837 2 BrN2O3C14H22 AB2C3D14E22 -79.24 19.0 -8.03 -2.22 0
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424230 135121838 1 IN3O3C14H22 AB3C3D14E22 -101.08 10.47 -7.86 -0.71 2
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424231 135121843 2 NOC8H19 ABC8D19 -15.85 2.56 -2.82 -0.1 1
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424232 135121847 1 NO2C9H16 AB2C9D16 -53.17 7.66 0.0 0.0 0
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424233 135121859 1 O3C19H26 A3B19C26 -125.42 3.44 -8.97 -0.25 0
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424236 135121864 1 BrOH17C22 ABC17D22 26.42 5.48 -9.28 -0.92 0
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424237 135121871 1 ClOSN3C14H16 ABCD3E14F16 44.16 7.14 -8.55 -1.0 0
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424238 135121872 1 N4O5C11H14 A4B5C11D14 -140.68 12.43 -9.31 -0.44 0
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424239 135121873 1 N3O4C5H7 A3B4C5D7 -66.12 11.36 -9.2 -1.86 0
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424240 135121874 1 O7C22H28 A7B22C28 -274.64 9.29 -10.14 -0.84 0
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424241 135121875 1 N20O23C91H138 A20B23C91D138 -853.41 29.06 -9.06 -0.62 0
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424243 135121879 1 N3O5C11H17 A3B5C11D17 -79.9 26.87 -8.57 -2.58 0
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424245 135121881 1 O7C20H26 A7B20C26 -264.31 5.79 -10.28 -0.8 0
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424246 135121882 7 OC3H4 AB3C4 -257.16 3.41 -10.07 -0.65 1
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424247 135121883 1 O23C42H47 A23B42C47 -860.01 5.75 0.0 0.0 0
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424249 135121888 1 CoPO17N18C72H101 ABC17D18E72F101 -335.54 13.46 0.0 0.0 0
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424250 135121890 1 ClN3O4C16H22 AB3C4D16E22 -123.76 4.42 -9.55 -1.17 0
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424251 135121897 1 ClNF2O4H10C16 ABC2D4E10F16 -149.55 5.13 -9.17 -1.62 0
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424252 135121915 1 BNO3C16H22 ABC3D16E22 -183.95 1.38 -8.35 0.13 0
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424253 135121925 1 O2N7C14H19 A2B7C14D19 26.91 1.89 -8.66 -1.34 0
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424254 135121926 1 O2H6N6C7 A2B6C6D7 110.78 3.35 -9.31 -1.68 0
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424256 135121943 3 OC10H16 AB10C16 -206.36 4.33 -9.66 0.78 0
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424257 135121945 1 Si3O6C16H36 A3B6C16D36 -428.09 4.58 -9.7 0.46 -2
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424258 135121951 2 N3O4C11H14 A3B4C11D14 -293.32 7.97 -8.81 -0.55 0
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424259 135121957 1 NO5C10H15 AB5C10D15 -199.4 4.77 -9.06 -1.51 0
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424260 135121961 1 OH14C19 AB14C19 54.13 3.75 -7.99 -0.98 0