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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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217727 85088276 1 SiN2O4C20H34 AB2C4D20E34 -231.7 6.06 -8.9 -0.47 1
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217728 85088277 1 NaN2B3O6C16H16 AB2C3D6E16F16 -12.41 17.11 -6.68 -0.94 0
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217729 85088278 1 N2B3O6C16H16 A2B3C6D16E16 -70.43 1.68 0.0 0.0 0
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217730 85088279 1 ClO7H17C19 AB7C17D19 -248.32 7.34 -9.4 -1.44 0
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217731 85088284 1 NO8C19H23 AB8C19D23 -271.15 5.01 -9.47 -0.99 0
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217732 85088291 1 NS2O4C19H23 AB2C4D19E23 -129.19 5.4 -8.62 -0.05 0
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217733 85088292 1 NSO2C24H27 ABC2D24E27 -29.04 4.87 -8.17 -0.91 0
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217734 85088293 1 NSiO5C20H31 ABC5D20E31 -221.34 2.54 -8.61 -0.11 0
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217735 85088295 1 NOC27H39 ABC27D39 -76.59 5.69 -7.74 0.05 0
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217736 85088296 1 ClFON5C20H21 ABCD5E20F21 1.3 5.57 -8.84 -0.41 0
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217737 85088297 1 ClNSO3C20H24 ABCD3E20F24 -109.8 5.68 -9.51 -0.57 0
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217738 85088298 1 ClOS2N3C18H20 ABC2D3E18F20 21.38 4.82 -8.83 -0.88 0
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217739 85088300 1 IO4H11C16 AB4C11D16 -68.55 6.11 -9.3 -0.98 0
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217740 85088301 1 IO2C18H19 AB2C18D19 -43.18 2.08 -9.58 -0.94 0
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217741 85088302 1 BrN5H16C19 AB5C16D19 123.31 6.41 -8.98 -1.16 0
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217742 85088303 1 N2O7H14C20 A2B7C14D20 -60.6 5.94 -8.78 -1.97 0
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217743 85088309 1 N2O4C23H26 A2B4C23D26 -129.85 5.29 -9.6 -0.84 0
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217744 85088310 1 N2O4C23H26 A2B4C23D26 -43.54 6.61 -9.41 -0.38 0
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217745 85088311 1 N2O4C23H26 A2B4C23D26 -55.77 2.33 -9.49 -0.52 0
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217746 85088314 1 N2O3C24H30 A2B3C24D30 -65.7 3.7 -9.01 -0.2 0
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217747 85088315 1 N2O3C24H30 A2B3C24D30 -70.62 2.84 -8.92 -0.06 0
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217748 85088320 1 SiO3C24H30 AB3C24D30 -110.01 3.57 -9.5 -0.13 0
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217749 85088321 1 OSC26H34 ABC26D34 -35.76 1.83 -8.43 0.36 0
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217750 85088322 1 C29H46 A29B46 -67.21 1.35 -8.89 0.69 0
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217751 85088323 1 ClF2N2O4H13C18 AB2C2D4E13F18 -205.12 1.77 -9.24 -1.58 0
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217752 85088324 1 ClO2N4H19C21 AB2C4D19E21 -18.95 6.49 -9.22 -0.57 0
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217753 85088327 1 O4N7H17C18 A4B7C17D18 108.13 13.2 -8.74 -1.57 0
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217754 85088328 1 NO5C23H25 AB5C23D25 -115.26 4.01 -9.11 -0.04 0
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217755 85088331 1 FOSN3C22H22 ABCD3E22F22 4.94 3.97 -8.76 -0.82 0
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217756 85088332 1 NO4C23H41 AB4C23D41 -213.41 1.41 -10.46 -0.43 0
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217757 85088333 1 ClNO5C20H26 ABC5D20E26 -125.48 3.35 -8.31 -0.78 0
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217758 85088334 1 ClNS2O6C14H18 ABC2D6E14F18 -232.55 4.49 -9.56 -1.18 0
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217759 85088337 1 N4O5C20H20 A4B5C20D20 -88.27 5.79 -9.51 -1.9 0
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217760 85088342 1 N2O4C23H28 A2B4C23D28 -113.92 3.03 -9.04 -1.12 0
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217761 85088344 1 O4C25H32 A4B25C32 -136.66 5.05 -9.28 -1.11 0
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217762 85088345 2 SO2C10H14 AB2C10D14 -137.26 2.14 -8.48 -0.5 0
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217763 85088347 4 OC6H11 AB6C11 -248.7 2.15 -10.14 -0.48 0
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217764 85088348 1 SiO2C25H36 AB2C25D36 -118.44 1.86 -8.85 0.24 0
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217765 85088351 1 ClO6C20H25 AB6C20D25 -276.75 4.27 -9.67 -0.8 0
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217766 85088352 1 BrN2O3C19H19 AB2C3D19E19 -63.79 3.44 -9.05 -0.45 0
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217767 85088356 1 N5O6C17H29 A5B6C17D29 -223.15 7.61 -10.0 -0.16 0
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217768 85088357 1 NO5C23H27 AB5C23D27 -208.01 6.56 -9.36 -0.14 0
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217769 85088358 1 N3O6C19H31 A3B6C19D31 -259.4 5.03 -8.89 -0.34 0
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217770 85088359 1 O3N5C21H27 A3B5C21D27 -36.03 9.08 -9.03 -0.72 0
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217771 85088360 1 NS2O5C18H23 AB2C5D18E23 -160.64 2.42 -9.3 -0.89 0
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217772 85088361 1 FN3O3C21H38 AB3C3D21E38 -253.84 3.12 -10.36 -0.66 0
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217773 85088362 1 O2N3C24H35 A2B3C24D35 -90.76 3.48 -8.87 0.16 0
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217774 85088363 1 Cl3O8C12H19 A3B8C12D19 -402.58 2.95 -10.53 -0.26 0
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217775 85088364 1 NOC27H43 ABC27D43 60.57 1.58 -4.96 -1.34 0
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217776 85088366 1 SF3O7C15H17 AB3C7D15E17 -417.52 3.76 -9.82 -1.42 0