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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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78577 49693675 1 ClS3N4O4H15C16 AB3C4D4E15F16 -43.58 9.24 -9.03 -1.73 0
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78578 49693676 1 O2S2N3C17H17 A2B2C3D17E17 19.6 5.64 -9.03 -0.46 0
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78579 49693686 1 FS2N4O4C19H19 AB2C4D4E19F19 -102.12 6.07 -9.05 -0.96 0
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78580 49693700 1 SO2N5C13H13 AB2C5D13E13 39.75 8.34 -9.01 -0.6 0
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78581 49693706 1 ClSO2N3H12C15 ABC2D3E12F15 18.69 7.35 -9.36 -0.89 0
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78582 49693707 1 ClSO2N3H12C15 ABC2D3E12F15 18.74 6.15 -9.36 -0.88 0
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78583 49693722 1 ClS2N4O4H7C12 AB2C4D4E7F12 33.04 3.75 -9.53 -2.54 0
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78584 49693727 1 SCl2N3O3H11C15 AB2C3D3E11F15 -20.28 2.44 -9.18 -1.03 0
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78585 49693728 1 ClSN4O4H11C17 ABC4D4E11F17 -39.03 7.66 -9.33 -1.96 0
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78586 49693730 1 ClSN4O4H11C16 ABC4D4E11F16 37.61 7.12 -9.43 -1.85 0
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78587 49693731 1 ClSN3O4H12C16 ABC3D4E12F16 -53.8 4.17 -9.44 -1.56 0
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78588 49693733 1 ClS2N4O4C20H21 AB2C4D4E20F21 -60.59 5.25 -9.47 -1.48 0
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78589 49693735 1 ClS2N4O4C20H21 AB2C4D4E20F21 -63.31 6.27 -9.46 -1.48 0
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78590 49693738 1 ClSN4O4H9C14 ABC4D4E9F14 30.86 8.26 -9.36 -2.07 0
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78591 49693739 1 ClFSO2N3H9C14 ABCD2E3F9G14 -17.61 6.67 -9.36 -1.15 0
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78592 49693740 1 ClSN3O3H12C15 ABC3D3E12F15 -13.82 7.26 -9.3 -1.03 0
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78593 49693742 1 ClS2N4O4H17C21 AB2C4D4E17F21 -17.68 2.28 -9.04 -1.59 0
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78594 49693744 1 ClSN3O5C20H22 ABC3D5E20F22 -107.25 8.05 -9.15 -0.83 0
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78595 49693745 1 ClS2N4O4C19H21 AB2C4D4E19F21 -60.03 4.17 -9.58 -1.44 0
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78596 49699432 1 ClFN2O4C19H20 ABC2D4E19F20 -163.75 2.44 -9.61 -0.73 0
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78597 49700360 1 FS2O3N5C20H20 AB2C3D5E20F20 -51.95 5.73 -8.94 -1.29 0
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78598 49700562 1 S2O4N7H21C22 A2B4C7D21E22 43.29 13.71 -8.64 -1.12 0
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78599 49700602 1 S2O3N5C18H23 A2B3C5D18E23 -47.45 6.46 -8.86 -1.24 0
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78600 49700655 1 O2S3N5C22H23 A2B3C5D22E23 24.23 4.6 -8.83 -1.26 0
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78601 49700724 1 ClO2S2N5C18H28 AB2C2D5E18F28 -64.86 7.29 -9.32 -1.39 0