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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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173437 75637857 1 SCl2N3O3H18C20 AB2C3D3E18F20 -1.3 24.53 0.0 0.0 -1
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173438 75637858 1 S2N4O5H19C21 A2B4C5D19E21 -68.94 7.51 0.0 0.0 -1
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173439 75638204 1 ClFSN3O4H16C22 ABCD3E4F16G22 -94.42 5.31 0.0 0.0 0
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173440 75638838 1 ON5H21C24 AB5C21D24 133.65 10.76 -9.33 -1.16 -1
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173441 75638946 1 S2N3O5H16C20 A2B3C5D16E20 -35.55 4.41 0.0 0.0 -1
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173442 75638947 1 N2O5H25C28 A2B5C25D28 -53.24 6.35 0.0 0.0 -1
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173443 75638948 1 SN2H13C16 AB2C13D16 113.16 4.13 0.0 0.0 -1
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173444 75639293 1 ClNO4C16H19 ABC4D16E19 -165.98 4.49 0.0 0.0 0
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173445 75639578 1 ClSO2N5H20C21 ABC2D5E20F21 33.2 5.66 -8.65 -0.99 0
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173446 75639579 1 ClOSN5C23H24 ABCD5E23F24 54.92 4.59 -8.66 -1.0 0
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173447 75639580 1 ClOSN6C24H27 ABCD6E24F27 59.4 5.95 -8.24 -0.84 -1
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173448 75639838 1 ClSO2F3N4H13C18 ABC2D3E4F13G18 -63.0 6.86 0.0 0.0 2
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173449 75640189 1 O2N6C19H22 A2B6C19D22 38.68 7.79 -7.12 -0.42 0
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173450 75640241 1 F2O2N4H16C19 A2B2C4D16E19 -55.44 7.35 -9.28 -1.02 0
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173451 75640242 1 O2F4N5H13C18 A2B4C5D13E18 -136.2 9.37 -9.75 -1.55 0
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173452 75640243 1 O2F4N4H14C19 A2B4C4D14E19 -163.82 7.02 -9.45 -1.24 0
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173453 75640244 1 ClOF2N4H13C18 ABC2D4E13F18 -25.87 5.07 -9.59 -1.3 0
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173454 75640290 4 NC5H5 AB5C5 104.14 7.06 -9.12 -0.93 0
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173455 75640291 1 N5C19H19 A5B19C19 128.9 10.09 -9.49 -1.22 0
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173456 75640327 1 N5C19H19 A5B19C19 128.79 9.86 -9.54 -1.17 0
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173457 75640611 1 FNO2H6C9 ABC2D6E9 -94.72 5.56 -9.67 -1.22 -1
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173458 75640612 1 N3O3S3H8C15 A3B3C3D8E15 107.45 6.64 0.0 0.0 -1
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173459 75640613 1 N2O3S3H11C17 A2B3C3D11E17 99.92 26.41 0.0 0.0 -1
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173460 75640614 1 O2H13C16 A2B13C16 2.19 0.19 0.0 0.0 -1
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173461 75640615 1 NBr3O3C5H7 AB3C3D5E7 -85.09 3.0 0.0 0.0 -1
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173462 75640681 1 SO2N3H22C30 AB2C3D22E30 138.01 1.75 0.0 0.0 0
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173463 75640682 1 SO2N3H23C30 AB2C3D23E30 84.67 1.78 -8.86 -1.12 0
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173464 75641065 1 SO2N6C20H30 AB2C6D20E30 87.36 2.15 -8.98 -0.78 0
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173465 75641264 1 NCl2O2C13H15 AB2C2D13E15 -81.89 9.94 -9.3 -1.39 -1
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173466 75641631 1 ClO2N3H11C14 AB2C3D11E14 30.72 2.53 0.0 0.0 1
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173467 75641913 1 N2O2S2C6H11 A2B2C2D6E11 -75.13 7.77 0.0 0.0 -1
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173468 75641914 1 ON6H17C18 AB6C17D18 141.56 5.9 0.0 0.0 -1
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173469 75642152 1 OSN3H10C12 ABC3D10E12 97.8 2.33 0.0 0.0 0
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173470 75642153 1 O3N5C20H29 A3B5C20D29 -95.25 2.23 -9.01 0.12 -1
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173471 75642254 1 SF3N3O5C13H13 AB3C3D5E13F13 -308.72 0.9 0.0 0.0 0
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173472 75642558 1 SO2N5C22H33 AB2C5D22E33 -56.87 4.65 -9.27 -0.82 -1
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173473 75642588 1 O2N4H13C17 A2B4C13D17 111.82 4.92 0.0 0.0 0
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173474 75642998 1 N5O5C17H17 A5B5C17D17 -47.74 1.96 -8.81 -1.46 0
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173475 75642999 1 N5O5C17H17 A5B5C17D17 -46.16 2.82 -8.8 -1.44 0
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173476 75643000 1 SN4O5C16H16 AB4C5D16E16 -52.87 2.93 -8.71 -1.34 0
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173477 75643001 1 ClO2N4H15C16 AB2C4D15E16 -10.32 4.86 -8.72 -1.17 0
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173478 75643002 1 ClO2N4H15C16 AB2C4D15E16 -7.73 5.14 -8.78 -1.08 0
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173479 75643003 1 ClSO2N3H14C15 ABC2D3E14F15 -16.2 7.79 -8.62 -1.32 0
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173480 75643004 1 ClN3O3H14C15 AB3C3D14E15 -50.68 7.3 -8.64 -0.99 0
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173481 75643005 1 N3O3C16H17 A3B3C16D17 -38.73 5.49 -9.24 -0.65 0
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173482 75643006 1 N3O3C20H25 A3B3C20D25 -69.02 6.64 -9.27 -0.48 0
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173483 75643097 1 SO2N5H17C22 AB2C5D17E22 82.85 1.27 -8.65 -1.28 0
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173484 75643168 1 NO4C20H23 AB4C20D23 -130.42 3.41 -8.83 -0.05 0
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173485 75643169 1 NO3C22H27 AB3C22D27 -115.21 3.61 -9.09 -0.61 1
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173486 75643755 1 O2N3C22H28 A2B3C22D28 4.15 4.81 0.0 0.0 0