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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177002 76124080 1 S2N5O7H17C18 A2B5C7D17E18 -139.55 10.01 -9.12 -1.39 0
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177003 76124156 1 ClO4C10H11 AB4C10D11 -171.53 6.13 -10.65 -1.36 0
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177004 76124207 1 C10H10O11 A10B10C11 -430.91 8.24 -10.96 -1.74 0
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177005 76124315 1 SN3O5C9H15 AB3C5D9E15 -232.56 2.51 -9.35 -0.25 1
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177006 76124316 1 SN3O6C14H20 AB3C6D14E20 -222.38 5.28 0.0 0.0 0
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177007 76124317 6 OC3H4 AB3C4 -231.49 3.28 -9.81 -0.09 0
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177008 76124517 1 N4O12C45H68 A4B12C45D68 -575.22 8.13 -9.58 -0.34 0
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177009 76125490 1 S2N6O7C15H16 A2B6C7D15E16 -152.98 12.17 -9.66 -1.37 0
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177010 76125512 1 NPO8C41H78 ABC8D41E78 -535.97 2.9 -9.5 -0.6 0
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177011 76125552 2 NO4C13H17 AB4C13D17 -294.1 4.44 -9.01 -1.05 0
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177012 76125553 1 N4O4C25H32 A4B4C25D32 -95.53 5.44 -8.55 -0.38 0
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177013 76125563 2 OC11H17 AB11C17 -103.6 3.32 -8.89 -0.12 0
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177014 76125581 1 O2C45H74 A2B45C74 -189.54 2.74 -8.13 0.23 -2
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177015 76125617 1 S4N5O17H43C47 A4B5C17D43E47 -358.65 65.11 -8.56 -3.81 2
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177016 76125618 1 S4N5O17C47H47 A4B5C17D47E47 -464.09 13.71 -5.77 -2.77 0
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177017 76125619 1 O3C26H44 A3B26C44 -174.87 3.57 -9.4 0.62 0
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177018 76125620 1 O6C27H46 A6B27C46 -317.52 2.44 -9.68 0.95 0
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177019 76125621 1 NO2C20H33 AB2C20D33 -144.22 5.08 -9.29 0.67 0
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177020 76125622 1 N2O3C10H18 A2B3C10D18 -167.32 2.54 -10.02 0.14 0
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177021 76125623 2 O2N4C13H16 A2B4C13D16 -83.78 3.78 -9.46 -0.49 0
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177022 76125771 1 IN2O7C25H41 AB2C7D25E41 -349.46 6.23 -10.3 -1.88 0
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177023 76125772 1 N2O2F3C31H39 A2B2C3D31E39 -257.18 8.64 -9.15 -0.8 0
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177024 76126028 1 N7O10C39H63 A7B10C39D63 -515.59 2.39 -9.53 -0.46 0
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177025 76126076 1 IO3N4C10H11 AB3C4D10E11 -28.95 6.06 -10.06 -1.52 0
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177026 76126219 1 NO3C20H23 AB3C20D23 -83.71 3.65 -8.7 -0.62 0
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177027 76126220 4 OC2H4 AB2C4 -194.77 1.64 -10.24 -0.32 0
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177028 76126221 1 SN5O7C41H53 AB5C7D41E53 -272.64 4.39 -9.02 -0.64 0
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177029 76126222 1 NO11C32H51 AB11C32D51 -481.54 9.45 -8.59 -0.66 0
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177030 76126223 1 SO2N10C11H18 AB2C10D11E18 84.74 2.58 -8.9 -1.08 0
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177031 76126720 1 N2O5C26H26 A2B5C26D26 -102.54 6.22 -9.3 -0.53 1
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177032 76126721 1 FS3O5N8C32H34 AB3C5D8E32F34 -36.68 8.96 0.0 0.0 0
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177033 76126722 1 NPO7C25H30 ABC7D25E30 -270.87 8.03 -8.69 -0.28 0
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177034 76126723 1 NOSC11H21 ABCD11E21 -54.32 1.51 -8.72 0.5 0
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177035 76127579 1 NO4C19H29 AB4C19D29 -179.5 5.51 -9.04 0.53 0
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177036 76127979 1 S2O5N10C23H28 A2B5C10D23E28 -16.01 11.45 -7.66 -0.87 0
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177037 76128053 1 NSiO9C41H71 ABC9D41E71 -506.47 1.78 -9.21 -0.24 0
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177038 76128100 1 S2N5O6C32H41 A2B5C6D32E41 -234.23 2.03 -8.7 -1.36 0
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177039 76128369 1 O3N4H22C26 A3B4C22D26 -1.56 3.6 -8.3 -0.27 0
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177040 76129046 1 PSiN5O9C50H58 ABC5D9E50F58 -304.52 6.35 -8.7 -0.03 1
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177041 76129077 1 S3N8O8H23C24 A3B8C8D23E24 -146.52 9.79 0.0 0.0 0
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177042 76129078 2 OC13H13 AB13C13 -20.4 1.22 -8.7 -0.66 0
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177043 76129285 1 N2O3C17H18 A2B3C17D18 -79.06 4.62 -9.24 -0.38 0
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177044 76129286 1 ClFN3O4C23H27 ABC3D4E23F27 -146.47 7.57 -9.02 -0.42 0
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177045 76129509 3 NOC7H9 ABC7D9 -47.7 5.85 -8.65 -0.13 0
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177046 76130276 2 NOC32H34 ABC32D34 113.6 4.07 -8.0 0.22 0
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177047 76130277 2 O3C9H11 A3B9C11 -257.9 8.26 -9.99 -1.16 0
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177048 76130278 1 N3O4C21H27 A3B4C21D27 -112.17 2.96 -9.26 -0.24 0
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177049 76130312 1 N3O6C32H43 A3B6C32D43 -275.34 5.07 -9.83 -0.44 0
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177050 76130357 1 SN2O8C26H26 AB2C8D26E26 -255.36 3.89 -9.02 -1.66 0
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177051 76130398 1 O5C23H42 A5B23C42 -289.94 5.06 -10.04 0.37 0