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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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161753 57392547 1 FO2N4C30H31 AB2C4D30E31 -52.58 3.7 -8.77 -0.85 0
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161754 57392548 1 O2N4C33H38 A2B4C33D38 -23.49 1.14 -8.36 -0.64 0
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161757 57392555 1 F2N2O3H10C16 A2B2C3D10E16 -146.02 4.22 -8.93 -1.31 1
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161758 57392558 1 SN2H31C32 AB2C31D32 110.92 1.68 0.0 0.0 0
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161760 57392569 1 ClO2N5H16C21 AB2C5D16E21 37.39 3.93 -8.8 -1.36 0
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161761 57392572 1 SN2O7C21H22 AB2C7D21E22 -217.92 6.26 -8.74 -1.04 0
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161764 57392578 1 ClSN2O2C27H36 ABC2D2E27F36 -30.02 1.54 0.0 0.0 0
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161765 57392579 1 BrSN4C20H29 ABC4D20E29 24.37 5.98 -8.85 0.16 0
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161767 57392591 1 ClFSO3N4C30H30 ABCD3E4F30G30 -62.2 5.62 -8.6 -0.48 0
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161768 57392594 1 O4N5C19H19 A4B5C19D19 -83.98 1.67 -8.86 -0.92 0
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161769 57392597 1 N2O3C12H14 A2B3C12D14 -109.49 9.53 -9.43 -0.76 0
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161772 57392604 1 NO17C43H75 AB17C43D75 -870.97 5.07 -9.69 0.46 0
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161773 57392606 1 BrFN5O5H13C15 ABC5D5E13F15 -66.85 3.5 -9.83 -1.72 0
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161774 57392607 1 N5O6C27H31 A5B6C27D31 -159.59 3.66 -8.94 -0.57 0
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161775 57392613 1 ClSN2O2H19C20 ABC2D2E19F20 74.73 8.54 -8.42 -0.63 0
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161778 57392629 1 ClSN3O3H22C23 ABC3D3E22F23 -62.91 6.62 -8.65 -1.08 0
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161780 57392643 1 Cl3N4O6C34H37 A3B4C6D34E37 -187.03 8.1 -8.6 -0.5 0
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161783 57392652 1 FSO2N3H24C26 ABC2D3E24F26 -27.02 2.17 -9.25 -1.31 0
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161785 57392658 1 NO3C28H29 AB3C28D29 -76.18 3.67 -9.18 -0.34 0
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161786 57392662 1 ClN2C34H45 AB2C34D45 -16.18 4.67 -8.52 0.23 0
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161787 57392663 2 NC17H22 AB17C22 22.91 0.82 -8.34 0.39 0
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161789 57392674 1 ClO2F3N5H29C30 AB2C3D5E29F30 -164.59 11.15 -8.89 -1.16 0
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161790 57392677 1 ON7H27C28 AB7C27D28 113.02 2.02 -8.38 -0.92 0
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161791 57392685 1 PN5O8C11H16 AB5C8D11E16 -323.28 11.92 -9.47 -0.78 0
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161792 57392688 1 FN2O2C21H29 AB2C2D21E29 -129.11 2.9 -7.97 0.03 0