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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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442312 135251264 1 SO2N9C26H31 AB2C9D26E31 56.65 9.22 -8.3 -1.11 0
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442313 135251282 1 SN2O5F6C17H24 AB2C5D6E17F24 -536.73 8.28 -9.98 -0.35 0
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442314 135251294 1 O5N8H22C23 A5B8C22D23 -31.59 6.3 -8.36 -1.17 0
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442315 135251295 1 N3F4O5C23H27 A3B4C5D23E27 -358.54 4.65 -8.93 0.04 0
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442316 135251302 1 N2O4C19H34 A2B4C19D34 -236.82 1.0 -9.37 0.92 0
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442317 135251311 1 N3O3F4C15H19 A3B3C4D15E19 -302.26 4.51 -9.83 -0.16 0
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442318 135251313 1 N2F3O4C18H27 A2B3C4D18E27 -337.73 3.74 -9.52 -0.23 0
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442319 135251314 1 SN2F3O6C18H29 AB2C3D6E18F29 -417.88 10.52 -9.64 0.02 0
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442320 135251316 1 NOSC8H17 ABCD8E17 -52.91 4.83 -8.74 0.12 0
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442321 135251322 1 NO5C15H17 AB5C15D17 -165.89 3.28 -9.06 -0.01 0
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442322 135251344 1 O2N3C11H23 A2B3C11D23 -112.46 5.7 -9.14 1.16 0
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442323 135251358 1 INPO2C16H17 ABCD2E16F17 -61.29 2.7 -8.52 -0.98 0
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442324 135251360 1 N2O3C11H22 A2B3C11D22 -153.65 2.34 -8.93 0.19 1
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442325 135251361 1 ON2C8H17 AB2C8D17 -39.19 4.83 0.0 0.0 1
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442326 135251362 1 NOC6H10 ABC6D10 -31.51 4.84 0.0 0.0 0
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442327 135251363 2 NOC5H10 ABC5D10 -95.12 5.28 -9.13 0.41 0
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442328 135251364 1 O2N3C12H25 A2B3C12D25 -122.0 1.82 -9.04 1.17 0
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442329 135251366 1 ON2C8H16 AB2C8D16 -50.12 5.22 -9.75 1.14 0
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442330 135251376 1 O2N3C10H21 A2B3C10D21 -112.01 6.95 -9.26 1.18 0
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442331 135251381 1 O2N3C10H21 A2B3C10D21 -111.92 6.95 -9.27 1.18 0
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442332 135251382 1 O2N3C9H19 A2B3C9D19 -114.42 2.07 -9.46 1.23 0
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442333 135251384 1 FO3N4C19H23 AB3C4D19E23 -66.09 4.91 -8.87 -0.31 0
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442334 135251400 1 N2O3C9H18 A2B3C9D18 -150.33 9.45 -9.58 0.51 0
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442335 135251408 1 ON2C9H20 AB2C9D20 -66.22 3.61 -9.11 1.38 0
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442336 135251413 1 N3O4C12H23 A3B4C12D23 -197.21 11.28 -8.92 0.19 0