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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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38253 8028492 1 N3O4C21H25 A3B4C21D25 -128.59 7.65 -9.28 -0.82 0
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38254 8028496 1 FO3N4C22H23 AB3C4D22E23 -126.85 3.58 -8.84 -0.97 0
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38255 8028499 1 O4N5H17C20 A4B5C17D20 -21.37 11.9 -8.74 -1.66 0
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38256 8028500 1 NO5C17H21 AB5C17D21 -198.16 7.02 -9.35 -0.98 0
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38257 8028507 1 FN3O3H16C18 AB3C3D16E18 -131.03 3.37 -8.99 -1.01 0
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38258 8028510 1 NO5C22H23 AB5C22D23 -170.21 4.8 -9.24 -0.92 0
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38259 8028513 1 NO5C23H25 AB5C23D25 -177.0 7.0 -9.38 -0.71 0
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38260 8028514 1 NO5C23H25 AB5C23D25 -179.18 6.15 -9.41 -0.79 0
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38261 8028531 2 NSO2C7H8 ABC2D7E8 -128.43 5.93 -8.83 -0.74 0
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38262 8028538 1 ClNO5H20C21 ABC5D20E21 -169.21 5.59 -9.19 -1.15 0
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38263 8028558 1 O2N3C15H17 A2B3C15D17 -53.78 2.88 -9.31 -0.82 0
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38264 8028561 1 S2N3O4C16H17 A2B3C4D16E17 -90.92 5.87 -9.29 -0.99 0
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38265 8028566 1 O4N5H15C19 A4B5C15D19 -14.07 6.79 -8.65 -1.72 1
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38266 8028590 1 ClN2O5C19H24 AB2C5D19E24 -171.63 10.53 0.0 0.0 0
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38267 8028592 1 N2S2O5C18H20 A2B2C5D18E20 -161.13 8.23 -9.73 -0.92 1
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38268 8028597 1 N2O4C23H33 A2B4C23D33 -165.37 2.86 0.0 0.0 0
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38269 8028603 2 NO2C12H17 AB2C12D17 -188.91 2.64 -9.01 -0.95 -1
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38270 8028617 1 NSO6H18C21 ABC6D18E21 -139.4 5.7 0.0 0.0 0
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38271 8028637 1 Cl2N2S2O3H14C15 A2B2C2D3E14F15 -73.19 3.42 -9.7 -0.98 0
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38272 8028822 1 NSO3H21C23 ABC3D21E23 -54.17 4.63 -8.78 -1.0 0
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38273 8028823 1 NSO3H21C23 ABC3D21E23 -54.67 2.4 -8.75 -1.02 0
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38274 8028841 1 N2O4H20C21 A2B4C20D21 -105.62 4.12 -9.22 -1.04 0
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38275 8028847 2 NO2C11H15 AB2C11D15 -179.45 2.94 -8.97 -1.03 0
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38276 8028865 1 N3O4C21H23 A3B4C21D23 -110.24 8.68 -9.27 -1.08 1
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38277 8028945 1 N3O4C18H22 A3B4C18D22 -136.39 7.53 0.0 0.0 1
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38278 8029001 1 ClN3O3H17C22 AB3C3D17E22 -2.91 5.85 0.0 0.0 0
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38279 8029002 1 NO5H21C22 AB5C21D22 -168.73 4.08 -9.04 -1.15 0
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38280 8029012 1 SN2O2H14C19 AB2C2D14E19 25.6 2.19 -8.67 -1.7 0
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38281 8029014 1 SN3O4H13C20 AB3C4D13E20 -19.47 6.55 -9.27 -1.74 0
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38282 8029033 1 SN2O6C19H20 AB2C6D19E20 -212.29 7.84 -9.23 -1.35 -1
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38283 8029041 1 N2S2O3H11C16 A2B2C3D11E16 18.11 5.74 0.0 0.0 0
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38284 8029170 1 FSN2O4H13C21 ABC2D4E13F21 -77.0 4.52 -9.06 -1.5 0
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38285 8029172 1 FN2S2O5H15C16 AB2C2D5E15F16 -217.79 8.92 -9.9 -1.75 1
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38286 8029193 1 N2O5C23H25 A2B5C23D25 -108.73 6.62 0.0 0.0 0
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38287 8029203 1 N3O5C23H25 A3B5C23D25 -97.76 2.57 -8.79 -1.27 0
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38288 8029295 1 SN2O5C20H20 AB2C5D20E20 -158.59 4.79 -9.35 -1.68 0
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38289 8029299 1 ClN3O5C20H22 AB3C5D20E22 -212.77 3.67 -9.35 -0.95 0
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38290 8029305 1 ClN3O5C20H22 AB3C5D20E22 -208.93 5.16 -9.43 -1.09 0
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38291 8029308 2 NSO2C10H12 ABC2D10E12 -115.17 2.27 -9.05 -1.51 0
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38292 8029362 1 N3O4C21H21 A3B4C21D21 -63.23 2.3 -8.78 -0.98 1
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38293 8029363 1 O3N5C16H22 A3B5C16D22 -39.16 3.77 0.0 0.0 0
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38294 8029439 1 ClN2S2O5H15C16 AB2C2D5E15F16 -179.16 6.1 -9.82 -1.64 0
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38295 8029470 1 N3O3C19H23 A3B3C19D23 -127.17 3.01 -8.99 -0.38 0
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38296 8029539 1 O2N3C18H19 A2B3C18D19 -39.16 5.12 -8.99 -0.52 0
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38297 8029540 1 SN2O3C13H18 AB2C3D13E18 -131.14 3.17 -8.3 -0.41 0
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38298 8029553 1 O2F3N3H14C20 A2B3C3D14E20 -166.16 8.37 -9.78 -1.06 0
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38299 8029554 1 O2F3N3H14C20 A2B3C3D14E20 -166.12 8.43 -9.78 -1.07 0
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38300 8029656 1 SO2N4C18H18 AB2C4D18E18 -1.72 2.57 -8.84 -0.99 0
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38301 8029657 1 F2O2N3H13C19 A2B2C3D13E19 -93.13 4.62 -9.58 -0.89 0
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38302 8029670 1 N3O3C20H23 A3B3C20D23 -82.03 2.46 -8.39 -1.41 0