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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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133561 51550641 1 N3O5C22H22 A3B5C22D22 -106.73 3.4 0.0 0.0 0
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133562 51552147 1 Cl2N3O4C22H25 A2B3C4D22E25 -141.5 1.3 -9.07 -1.11 0
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133563 51552352 1 O2N3C21H25 A2B3C21D25 -4.37 2.51 -8.08 -0.4 0
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133564 51552353 1 FO4N5H24C26 AB4C5D24E26 -12.4 7.67 -8.5 -1.46 0
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133565 51552354 1 O2N4C29H32 A2B4C29D32 49.82 5.16 -8.38 -1.46 -1
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133566 51553103 1 SF3N3O4H15C18 AB3C3D4E15F18 -215.07 7.89 0.0 0.0 0
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133567 51553951 1 SCl2N3O3H17C20 AB2C3D3E17F20 -64.6 6.47 -8.89 -1.06 0
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133568 51553960 1 SCl2N2O4C20H22 AB2C2D4E20F22 -145.28 3.2 -9.11 -1.34 0
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133569 51553967 1 SN2O4C19H28 AB2C4D19E28 -162.8 8.7 -9.0 -0.21 0
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133570 51554465 1 FNO4H24C25 ABC4D24E25 -123.61 7.67 -8.51 -0.25 0
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133571 51555002 1 N2O5H22C26 A2B5C22D26 -70.71 4.68 -8.82 -0.5 0
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133572 51555646 1 ClN3O5C24H24 AB3C5D24E24 -145.98 4.31 -9.34 -0.66 -1
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133573 51555726 1 ClFN3O5H18C23 ABC3D5E18F23 -179.35 3.48 0.0 0.0 0
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133574 51556478 1 F3O3N4C21H23 A3B3C4D21E23 -233.93 2.84 -8.46 0.04 0
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133575 51556674 1 SO2N5C19H29 AB2C5D19E29 -56.95 2.06 -8.8 -0.51 1
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133576 51556843 1 NO4C12H22 AB4C12D22 -187.51 4.53 0.0 0.0 0
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133577 51557001 1 FNO2C13H16 ABC2D13E16 -126.59 6.35 -9.54 -0.28 0
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133578 51557110 1 NOC10H13 ABC10D13 -30.45 0.51 -8.69 0.2 0
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133579 51557347 1 NS3O5C19H19 AB3C5D19E19 -128.96 9.8 -8.49 -1.02 -1
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133580 51557502 1 Cl2N2S3O4H13C14 A2B2C3D4E13F14 -75.15 7.29 0.0 0.0 0
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133581 51557707 1 NSO6C27H29 ABC6D27E29 -202.14 8.15 -8.45 -0.71 -1
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133582 51557723 1 SN2F3O3H16C18 AB2C3D3E16F18 -186.32 10.73 0.0 0.0 -1
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133583 51557770 1 ClN2S3O4C17H20 AB2C3D4E17F20 -65.92 7.54 0.0 0.0 2
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133584 51557959 1 BrSN3C6H14 ABC3D6E14 -4.87 3.84 -8.99 -0.46 1
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133585 51558306 1 FN2O2C23H24 AB2C2D23E24 -32.86 6.7 0.0 0.0 0