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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36702 8011519 1 O3N4C22H26 A3B4C22D26 -51.27 6.85 -8.96 -0.24 0
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36703 8011567 1 N3O3H19C21 A3B3C19D21 65.86 4.47 -8.9 -1.59 0
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36704 8011577 1 FO2N5C19H20 AB2C5D19E20 -69.93 7.95 -8.46 -0.28 0
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36705 8011582 1 SN3O6C19H19 AB3C6D19E19 -208.0 7.04 -8.74 -1.66 0
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36706 8011585 1 SN5C12H13 AB5C12D13 96.45 5.14 -9.05 -0.41 0
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36707 8011602 1 NO5C22H25 AB5C22D25 -173.22 5.82 -8.83 -0.76 0
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36708 8011616 1 NO5C19H21 AB5C19D21 -172.35 2.2 -8.69 -0.07 0
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36709 8011621 1 SO2N4C20H22 AB2C4D20E22 20.62 3.9 -9.4 -1.06 0
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36710 8011661 1 NO4C22H27 AB4C22D27 -152.7 5.29 -8.78 -0.08 0
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36711 8011669 1 ClN3O3H16C21 AB3C3D16E21 26.93 3.6 -9.48 -1.08 0
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36712 8011683 1 NO4C19H27 AB4C19D27 -186.67 5.2 -9.02 -0.04 0
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36713 8011686 1 NO4C19H27 AB4C19D27 -186.81 6.29 -9.13 -0.18 0
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36714 8011687 1 NO4C19H27 AB4C19D27 -184.97 3.55 -8.95 0.03 0
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36715 8011689 1 N2O5C18H22 A2B5C18D22 -166.84 7.28 -9.05 -0.99 0
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36716 8011756 1 N3O3H15C17 A3B3C15D17 -51.3 2.64 -8.76 -1.39 0
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36717 8011779 1 O6H20C21 A6B20C21 -204.8 7.2 -9.09 -1.14 0
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36718 8011781 1 N2O5C22H26 A2B5C22D26 -153.94 3.4 -8.27 0.05 0
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36719 8011783 1 ON2S2H20C23 AB2C2D20E23 49.87 3.94 -8.95 -0.75 0
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36720 8011787 1 NO3H17C18 AB3C17D18 -77.03 3.42 -8.28 -0.25 0
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36721 8011800 1 SN2O6C19H22 AB2C6D19E22 -216.16 4.4 -8.71 -0.68 0
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36722 8011831 1 NO4C21H25 AB4C21D25 -148.49 4.67 -9.05 -0.09 0
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36723 8011832 1 N2O5C21H22 A2B5C21D22 -138.85 5.55 -8.82 -0.78 0
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36724 8011876 1 SN3O5C15H25 AB3C5D15E25 -246.76 5.23 -10.21 0.05 0
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36725 8011891 1 OS2N5H15C17 AB2C5D15E17 104.22 3.61 -8.18 -0.85 0
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36726 8011899 1 NO5C21H25 AB5C21D25 -174.2 4.58 -8.53 -0.88 0
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36727 8011901 1 N2O5C17H22 A2B5C17D22 -202.03 3.23 -8.67 0.33 0
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36728 8011923 1 NF3O5H16C18 AB3C5D16E18 -316.8 7.93 -9.12 -1.1 0
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36729 8011925 1 ClNO4C19H20 ABC4D19E20 -143.97 5.72 -9.04 -0.25 0
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36730 8011926 1 O2N3H25C26 A2B3C25D26 4.34 7.97 -8.53 -0.42 0
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36731 8011928 1 NO7C19H19 AB7C19D19 -238.2 8.15 -9.1 -1.07 1
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36732 8011982 1 ClN2O3C18H20 AB2C3D18E20 -36.35 6.84 0.0 0.0 0
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36733 8012003 1 NO4C16H21 AB4C16D21 -147.96 5.84 -9.19 -0.18 0
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36734 8012006 2 NO3C11H13 AB3C11D13 -210.38 2.01 -8.65 -0.55 0
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36735 8012007 1 SN2O3C13H18 AB2C3D13E18 -81.97 2.53 -8.53 -0.63 0
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36736 8012008 1 NO5H17C18 AB5C17D18 -153.27 4.01 -8.78 -1.2 0
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36737 8012028 1 NO6H19C24 AB6C19D24 -151.67 7.53 -9.09 -1.26 0
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36738 8012035 1 N2O6C21H24 A2B6C21D24 -211.72 5.83 -8.86 -0.98 1
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36739 8012036 1 ON5C23H28 AB5C23D28 77.81 7.17 0.0 0.0 0
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36740 8012037 1 ON5C23H27 AB5C23D27 54.87 5.85 -8.76 -0.45 0
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36741 8012038 1 SN2O5C21H26 AB2C5D21E26 -160.28 4.88 -8.85 -0.62 0
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36742 8012039 1 ClO2S2N4H13C15 AB2C2D4E13F15 41.97 5.26 -9.0 -1.29 0
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36743 8012040 1 NSO5H19C20 ABC5D19E20 -115.36 4.03 -8.8 -0.91 0
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36744 8012057 2 OSN2H5C8 ABC2D5E8 48.75 1.61 -8.8 -1.39 0
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36745 8012060 1 NF3O3H16C17 AB3C3D16E17 -251.4 6.53 -9.1 -0.66 0
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36746 8012126 2 O2H7C8 A2B7C8 -106.15 2.49 -9.14 -0.78 0
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36747 8012127 1 SO2N3C13H13 AB2C3D13E13 -1.15 2.59 -9.66 -1.39 0
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36748 8012142 1 SO3N5H15C16 AB3C5D15E16 19.33 3.39 -8.62 -1.19 0
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36749 8012146 1 FNO5H14C17 ABC5D14E17 -191.51 4.81 -8.77 -1.2 0
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36750 8012157 1 O6H14C17 A6B14C17 -168.16 4.65 -9.03 -0.62 0
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36751 8012192 1 O2N5C22H23 A2B5C22D23 1.59 5.53 -8.59 -1.43 0