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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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185876 77364551 1 NSO3C17H17 ABC3D17E17 -45.76 5.42 -8.96 -0.66 0
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185877 77364564 1 NO9C42H49 AB9C42D49 -288.58 6.52 -9.21 -0.26 0
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185878 77364641 1 SiN3O7C25H40 AB3C7D25E40 -285.1 5.46 0.0 0.0 0
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185879 77364847 2 N2O3C8H12 A2B3C8D12 -252.4 7.99 -9.58 -0.74 0
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185880 77365054 1 SO8C19H20 AB8C19D20 -278.22 3.25 -9.94 -1.17 0
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185881 77365260 1 O2N4C17H22 A2B4C17D22 -59.66 5.66 -9.57 -0.2 0
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185882 77365261 2 ON2C8H14 AB2C8D14 -95.79 4.86 -9.31 -0.21 0
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185883 77365305 1 PN4O8C34H39 AB4C8D34E39 -285.19 9.59 -8.94 -0.18 1
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185884 77365368 1 N2O2C25H39 A2B2C25D39 -88.42 2.82 0.0 0.0 0
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185885 77365369 1 N2O3C27H40 A2B3C27D40 -135.79 7.61 -9.59 0.08 0
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185886 77365370 1 NSO3C9H15 ABC3D9E15 -143.59 6.42 -9.19 -0.24 0
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185887 77365697 1 ClSN4O5C24H37 ABC4D5E24F37 -225.73 2.21 -8.71 -0.18 0
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185888 77365899 1 NO3C36H69 AB3C36D69 -266.51 6.87 -9.26 0.61 0
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185889 77365900 2 O2C14H21 A2B14C21 -239.26 2.16 -8.75 0.27 0
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185890 77365901 1 N3O3C17H19 A3B3C17D19 -46.97 5.96 -8.35 -1.22 0
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185891 77366074 1 O4N6C13H18 A4B6C13D18 -86.6 3.82 -8.43 -0.71 0
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185892 77366220 5 OC5H6 AB5C6 -182.82 3.06 -9.44 0.18 0
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185893 77366221 1 ON2F4C29H32 AB2C4D29E32 -164.02 2.42 -8.8 -0.47 0
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185894 77366222 2 NOC7H7 ABC7D7 -6.21 3.18 -8.99 -0.52 0
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185895 77366386 1 ClO2N3H18C19 AB2C3D18E19 -16.23 4.58 -8.7 -0.74 0
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185896 77366387 1 Br4H4C5O5 A4B4C5D5 -185.77 3.14 -10.85 -2.33 0
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185897 77366388 1 ClN3O14C26H30 AB3C14D26E30 -518.66 6.17 -9.62 -1.34 0
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185898 77366389 1 ClN3O14C26H32 AB3C14D26E32 -518.16 11.78 -9.53 -1.24 0
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185899 77366535 1 ZnN4O6C33H42 AB4C6D33E42 -208.65 14.54 -7.76 -1.71 0
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185900 77366536 1 N2S3O6C21H28 A2B3C6D21E28 -105.45 7.42 -8.25 -1.03 0