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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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305272 124767855 1 O3C22H32 A3B22C32 -156.65 3.94 -9.85 -0.27 0
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305275 124767947 1 NO4C26H30 AB4C26D30 -89.6 3.91 0.0 0.0 1
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305276 124767948 1 NO4C26H30 AB4C26D30 -85.92 3.84 0.0 0.0 1
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305277 124767949 1 NO4C26H30 AB4C26D30 -72.02 1.53 0.0 0.0 1
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305278 124767950 1 NO4C26H30 AB4C26D30 -87.34 4.49 0.0 0.0 0
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305279 124767951 1 N2O3H18C22 A2B3C18D22 41.85 4.36 -9.05 -1.27 0
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305286 124767959 2 OC10H15 AB10C15 -122.84 2.03 -9.41 0.36 0
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305287 124767960 1 SN2O3H30C31 AB2C3D30E31 -55.81 4.55 -8.82 -0.63 0
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305297 124767970 1 N4O7C9H10 A4B7C9D10 -140.74 6.13 -10.07 -1.65 0
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305300 124767973 1 SCl2N2O3C20H20 AB2C2D3E20F20 -81.04 4.27 -9.06 -0.81 0
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305301 124767974 1 SCl2N2O3C20H20 AB2C2D3E20F20 -90.71 2.73 -8.68 -0.61 0
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305305 124767978 1 NO3C17H19 AB3C17D19 -91.28 7.34 -9.04 -0.29 0
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305306 124767979 1 ClN2S2O5C27H27 AB2C2D5E27F27 -156.34 5.48 -8.84 -1.0 0
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305307 124767981 1 NO5H13C14 AB5C13D14 -151.4 6.52 -9.12 -0.55 0
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305308 124767982 1 NO5H13C14 AB5C13D14 -148.93 4.08 -8.82 -0.35 0
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305311 124767985 1 N2O7C23H28 A2B7C23D28 -83.22 7.18 -8.74 -1.29 0
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305316 124767990 1 N2O2S2F3C19H21 A2B2C2D3E19F21 -222.27 6.75 -8.9 -0.96 0
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305317 124767991 1 N2O2S2F3C19H21 A2B2C2D3E19F21 -222.96 5.28 -8.86 -1.02 0
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305320 124767994 1 ClSN2O3H25C29 ABC2D3E25F29 -52.11 3.76 -8.92 -0.65 0
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305321 124767995 1 N2O3C14H14 A2B3C14D14 -66.41 5.09 -9.78 -0.46 0
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305325 124767999 1 O3C25H30 A3B25C30 -111.09 3.5 -9.57 -0.63 0
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305333 124768008 1 ClO3N6H31C34 AB3C6D31E34 67.42 5.66 -8.88 -0.78 0
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305334 124768009 1 ClO3N6H31C34 AB3C6D31E34 59.77 9.02 -9.16 -0.64 0
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305336 124768011 1 NSO5C23H23 ABC5D23E23 -140.39 7.24 -9.19 -1.0 0
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305337 124768012 1 NSO5C23H23 ABC5D23E23 -147.45 6.06 -8.95 -1.05 0
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305339 124768014 1 NF6O7C19H21 AB6C7D19E21 -615.84 5.53 -9.44 -0.31 0
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305340 124768015 1 NF6O7C19H21 AB6C7D19E21 -607.36 5.35 -9.54 -0.2 0
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305345 124771950 1 SN3O3C20H25 AB3C3D20E25 -87.65 9.19 -9.55 -0.96 0
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305346 124771952 1 N3O6C18H19 A3B6C18D19 -115.49 8.37 -9.51 -1.19 0
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305347 124771958 1 O2N3C24H27 A2B3C24D27 -46.45 1.11 -9.04 -0.27 0
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305348 124771969 1 FN2O4H23C27 AB2C4D23E27 -140.44 4.2 -9.36 -0.47 0
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305349 124772001 1 SO2N4C25H32 AB2C4D25E32 -27.52 3.02 -8.44 -0.72 0
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305351 124772043 1 SN3O5C27H37 AB3C5D27E37 -157.64 7.72 -9.07 -1.02 0
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305352 124772044 1 SO2N5C18H27 AB2C5D18E27 -67.67 5.99 -8.21 -0.3 0
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305353 124772051 1 OSN3C24H25 ABC3D24E25 23.94 3.39 -8.72 -1.23 0
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305354 124772052 1 OSN3C24H25 ABC3D24E25 23.94 6.14 -8.74 -1.16 0
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305355 124772053 1 SN3O5C21H21 AB3C5D21E21 -50.95 7.6 -9.45 -2.21 0
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305356 124772058 1 SO2N4C25H30 AB2C4D25E30 -29.77 3.19 -8.64 -0.76 0
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305357 124772072 1 SN3O3C22H31 AB3C3D22E31 -108.63 6.8 -8.49 -0.54 0
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305358 124772079 1 N3O3C27H29 A3B3C27D29 -71.43 6.49 -8.56 -0.34 0
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305359 124772138 1 N2O4C19H28 A2B4C19D28 -190.52 4.97 -8.84 -0.66 0
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305360 124772162 1 FNO3C18H24 ABC3D18E24 -189.1 4.54 -9.6 -0.1 0
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305362 124772191 1 SO2N3C19H25 AB2C3D19E25 -80.25 2.72 -9.23 -1.08 0
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305363 124772203 1 N4O4H16C17 A4B4C16D17 58.85 10.34 -9.48 -1.63 0
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305366 124772278 1 ClSN2O2C21H27 ABC2D2E21F27 -57.04 4.87 -8.89 -0.84 0
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305367 124772303 1 BrN2S2O3C20H25 AB2C2D3E20F25 -85.15 4.02 -9.6 -1.25 0
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305368 124772308 1 SN4O4C22H36 AB4C4D22E36 -154.88 6.45 -8.57 -0.29 0
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305369 124772316 1 OSN3C22H31 ABC3D22E31 -45.72 3.41 -8.69 -0.69 0
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305370 124772325 1 OSN5C19H27 ABC5D19E27 12.16 12.01 -8.23 -0.42 0
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305371 124772352 1 FN3O3C24H26 AB3C3D24E26 -132.78 5.87 -9.44 -0.5 0