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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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135337 51852520 1 NO3C18H22 AB3C18D22 -59.4 4.31 0.0 0.0 0
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135338 51852838 1 ClNS2O7H14C16 ABC2D7E14F16 -236.88 6.45 -9.33 -2.28 0
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135339 51853048 1 F3N3C18H22 A3B3C18D22 -134.57 5.45 -9.11 -0.73 0
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135340 51853462 1 SO2F3N5C14H20 AB2C3D5E14F20 -187.74 12.15 -9.55 -0.23 0
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135341 51853577 1 SO2F3N5C14H20 AB2C3D5E14F20 -182.15 11.13 -9.96 -0.15 0
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135342 51854019 1 ON6C24H28 AB6C24D28 52.78 6.83 -8.88 -0.56 0
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135343 51854393 2 ON3C12H14 AB3C12D14 30.88 5.33 -8.75 -0.63 0
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135344 51855127 1 ClON7C20H20 ABC7D20E20 94.15 1.72 -9.4 -1.99 1
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135345 51855771 1 ClSN3O3C20H21 ABC3D3E20F21 -38.55 4.33 0.0 0.0 0
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135346 51855888 1 ClNOF2H16C18 ABCD2E16F18 -106.0 3.45 -9.51 -0.36 0
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135347 51856366 1 NSO5C23H25 ABC5D23E25 -157.46 3.62 -9.41 -1.01 0
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135348 51856367 1 ClON2C18H19 ABC2D18E19 -18.97 5.04 -8.76 -0.05 0
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135349 51857447 1 N2O3C22H24 A2B3C22D24 -62.91 5.07 -8.78 -0.58 0
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135350 51857593 1 N3O3C15H23 A3B3C15D23 -118.42 5.96 -9.35 0.6 1
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135351 51857828 1 SN3O3C25H36 AB3C3D25E36 -93.88 6.91 0.0 0.0 0
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135352 51858396 2 NSO2C9H11 ABC2D9E11 -129.77 7.53 -8.49 -1.06 0
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135353 51858441 1 SN3O3C25H29 AB3C3D25E29 -90.2 4.5 -8.86 -0.72 0
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135354 51858467 1 N4O5H26C28 A4B5C26D28 -139.54 6.71 -9.25 -0.96 0
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135355 51858786 1 SN4O5C26H30 AB4C5D26E30 -97.18 8.23 -8.64 -1.25 0
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135356 51858787 1 SN4O5C26H30 AB4C5D26E30 -91.32 7.3 -8.6 -1.25 1
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135357 51858788 1 SO3N6C22H27 AB3C6D22E27 -1.06 5.88 0.0 0.0 0
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135358 51858791 1 SO3N4C19H22 AB3C4D19E22 -14.03 8.54 -9.21 -1.39 0
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135359 51859026 1 O2S3N4H18C20 A2B3C4D18E20 54.44 3.91 -8.96 -1.52 0
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135360 51859027 1 O2S3N4C22H22 A2B3C4D22E22 52.41 1.74 -8.68 -1.15 0
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135361 51859396 1 ClSO2N4H13C18 ABC2D4E13F18 64.16 9.54 -8.74 -1.52 0