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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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152539 56311493 1 N2O5C25H28 A2B5C25D28 -164.19 7.08 -8.58 -0.96 0
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152540 56311494 1 FN2O3C22H27 AB2C3D22E27 -134.67 2.3 -8.67 -0.08 0
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152541 56311495 1 ClN3O3C23H28 AB3C3D23E28 -108.88 3.93 -8.67 -0.2 0
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152542 56311497 1 N3O5C23H33 A3B5C23D33 -212.83 4.11 -8.57 -0.09 0
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152543 56311498 1 O3N4C22H32 A3B4C22D32 -104.67 8.72 -8.73 -0.27 0
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152544 56311499 1 O3N4C24H28 A3B4C24D28 -66.35 7.81 -8.57 -0.78 0
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152545 56311500 1 F2N2O2C21H24 A2B2C2D21E24 -153.56 1.37 -9.02 -0.26 0
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152546 56311501 1 BrSO2N4C20H21 ABC2D4E20F21 33.89 2.22 -9.21 -1.26 0
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152547 56311503 1 SO2N6C22H24 AB2C6D22E24 21.3 2.77 -9.15 -1.54 0
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152548 56311504 1 FO2N4C25H31 AB2C4D25E31 -84.39 2.22 -8.99 -0.31 0
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152549 56311505 2 ON3C12H16 AB3C12D16 -31.98 4.46 -8.75 -0.36 0
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152550 56311506 1 O2N4C25H28 A2B4C25D28 -25.48 2.08 -8.81 -0.81 0
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152551 56311507 1 O3N4C27H34 A3B4C27D34 -95.45 3.82 -9.19 -0.34 0
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152552 56311508 1 Cl2O2N3C22H25 A2B2C3D22E25 -67.55 4.46 -8.87 -0.62 0
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152553 56311509 1 Cl2O2N3C22H25 A2B2C3D22E25 -71.71 2.76 -9.11 -0.65 0
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152554 56311510 1 FO2N5C25H28 AB2C5D25E28 -49.55 5.74 -8.95 -0.63 0
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152555 56311511 1 SO4N5C23H31 AB4C5D23E31 -128.28 2.68 -9.11 0.04 0
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152556 56311512 1 F3N3O3C23H26 A3B3C3D23E26 -255.88 4.52 -9.16 -0.56 0
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152557 56311513 2 N2O2C11H13 A2B2C11D13 -49.7 5.38 -9.22 -1.56 0
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152558 56311514 1 Cl2O2N3C22H25 A2B2C3D22E25 -67.79 1.56 -9.18 -0.55 0
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152559 56311515 4 NOC6H7 ABC6D7 -56.92 5.93 -9.27 -1.27 0
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152560 56311516 1 SN4O4C22H28 AB4C4D22E28 -127.1 5.07 -9.21 -0.67 0
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152561 56311517 1 O2F3N3C23H26 A2B3C3D23E26 -215.06 2.29 -9.14 -0.7 0
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152562 56311518 1 N3O3C21H25 A3B3C21D25 -16.25 7.99 -9.01 -1.37 0
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152563 56311520 1 ClO3N4C22H25 AB3C4D22E25 -74.24 3.49 -9.08 -0.74 0