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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177077 76132544 1 NO5C16H23 AB5C16D23 -225.62 6.68 -9.95 -0.27 0
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177078 76133073 1 N5O8C44H83 A5B8C44D83 -471.33 5.7 -9.53 -0.45 0
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177079 76133074 1 O7C25H46 A7B25C46 -382.6 6.91 -9.65 -0.35 0
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177080 76133075 1 N4O7C36H62 A4B7C36D62 -381.54 4.91 -9.91 -0.51 0
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177081 76133138 1 S3N9O9H21C25 A3B9C9D21E25 -144.8 3.95 -8.93 -1.52 0
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177082 76133139 1 NS2O4C6H11 AB2C4D6E11 -167.88 1.77 -9.42 -0.27 0
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177083 76133140 1 N2O7C24H30 A2B7C24D30 -248.33 3.82 -8.74 -0.37 0
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177084 76133141 1 N2O3C29H58 A2B3C29D58 -251.62 1.34 -9.35 0.26 0
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177085 76133267 1 ClS2N5O7C22H22 AB2C5D7E22F22 -175.48 4.71 -9.64 -2.0 0
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177086 76133494 1 N5O6C12H15 A5B6C12D15 -120.43 4.19 -10.18 -1.72 1
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177087 76133524 1 S3O5N6H19C21 A3B5C6D19E21 -2.18 13.83 0.0 0.0 0
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177088 76133560 1 SN2O3C39H40 AB2C3D39E40 -24.96 3.46 -8.38 -0.21 0
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177089 76133561 1 O2N5F6C37H39 A2B5C6D37E39 -271.97 7.36 -8.91 -1.52 0
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177090 76133562 1 NO4C24H31 AB4C24D31 -129.35 5.1 -9.86 -0.74 0
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177091 76134314 1 N3O4C29H33 A3B4C29D33 -58.3 1.73 -8.74 -0.61 0
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177092 76134382 1 ON2C11H16 AB2C11D16 45.41 3.47 -8.51 -0.06 0
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177093 76134990 1 N2O3C9H16 A2B3C9D16 -131.69 6.71 -9.62 -0.39 0
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177094 76135139 1 IO3C14H21 AB3C14D21 -107.16 1.62 -9.3 -2.62 0
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177095 76135274 1 SN5O7C34H55 AB5C7D34E55 -357.37 4.59 -8.53 0.01 0
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177096 76135275 1 ClO5C21H33 AB5C21D33 -257.15 7.99 -9.99 0.42 0
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177097 76135276 1 S2N3O4H29C34 A2B3C4D29E34 -9.77 2.0 -9.16 -1.24 0
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177098 76135331 1 N5O6C37H45 A5B6C37D45 -219.59 6.08 -9.06 -0.7 0
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177099 76135365 1 N11O16C41H61 A11B16C41D61 -663.64 4.03 -9.32 -0.8 0
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177100 76135366 4 NOC8H12 ABC8D12 -48.53 4.41 -8.73 -0.62 0
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177101 76135367 1 N2O4C13H18 A2B4C13D18 -121.73 6.18 -8.46 -0.07 0