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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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217551 85087992 1 CuN2O2C19H22 AB2C2D19E22 58.1 9.36 0.0 0.0 0
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217552 85087993 1 NaSO2N3H18C19 ABC2D3E18F19 35.18 20.67 -7.17 -0.82 0
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217553 85087994 1 SO2N3C19H19 AB2C3D19E19 42.29 3.18 -8.83 -0.87 0
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217554 85087995 1 NSO7C16H25 ABC7D16E25 -291.16 3.22 -9.17 -0.42 0
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217555 85087996 1 NSO5C19H21 ABC5D19E21 -179.97 8.42 -9.06 -0.16 1
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217556 85087997 1 FO2N5C19H27 AB2C5D19E27 -69.67 5.38 0.0 0.0 0
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217557 85087998 1 N3O4C20H29 A3B4C20D29 -170.16 3.98 -9.74 -0.44 0
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217558 85087999 1 N3O4C20H29 A3B4C20D29 -126.54 4.74 -9.32 -0.74 0
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217559 85088000 1 O2N3C23H25 A2B3C23D25 -20.9 2.63 -8.28 -0.57 0
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217560 85088002 1 OSN3C22H25 ABC3D22E25 19.68 6.34 -8.92 -0.62 0
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217561 85088003 1 ClFO3N5H15C16 ABC3D5E15F16 -107.52 4.47 -9.44 -0.78 0
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217562 85088004 1 ClN3O5H14C17 AB3C5D14E17 7.44 6.58 -9.45 -1.76 0
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217563 85088005 1 OSiTeC15H24 ABCD15E24 -76.96 1.44 -8.07 0.07 0
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217564 85088006 1 IO3C15H21 AB3C15D21 -114.47 2.03 -9.43 -0.76 0
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217565 85088007 1 IOSC15H21 ABCD15E21 -35.05 4.22 -8.75 -0.74 0
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217566 85088008 1 PN4O7C13H21 AB4C7D13E21 -305.35 7.85 -9.62 -0.56 0
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217567 85088009 1 N4O6C17H20 A4B6C17D20 -121.63 9.55 -9.7 -1.78 0
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217568 85088012 1 SO3N4H18C19 AB3C4D18E19 13.01 7.53 -9.15 -1.61 0
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217569 85088013 1 O9C17H28 A9B17C28 -409.6 4.99 -10.11 0.42 0
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217570 85088019 1 N2O5C20H28 A2B5C20D28 -230.49 4.29 -9.95 -0.37 0
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217571 85088022 2 ON2C11H12 AB2C11D12 24.5 4.63 -8.94 -0.92 0
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217572 85088027 1 SiO4C21H32 AB4C21D32 -200.78 2.28 -9.74 -0.13 0
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217574 85088033 1 NO11C14H19 AB11C14D19 -417.71 7.21 -10.92 -0.8 0
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217575 85088034 1 NNaPO6C16H21 ABCD6E16F21 -355.75 10.55 -8.73 0.2 0
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217576 85088035 1 NPO6C16H22 ABC6D16E22 -313.1 5.41 -9.97 -0.21 0