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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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141363 52866940 1 O4N5C21H23 A4B5C21D23 -45.01 7.08 -8.82 -0.75 0
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141364 52867688 1 N5O5C21H27 A5B5C21D27 -137.51 4.24 -8.48 -0.44 0
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141365 52867952 1 SO2N3C23H23 AB2C3D23E23 -17.85 4.45 -9.05 -0.62 0
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141366 52868354 1 SN2O4C21H28 AB2C4D21E28 -149.18 9.1 -9.02 -0.85 0
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141367 52868396 1 FSN2O3C16H23 ABC2D3E16F23 -166.87 4.45 -9.46 -0.18 0
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141368 52869359 1 NOF3C14H16 ABC3D14E16 -201.36 5.87 -9.61 -0.52 0
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141369 52869399 1 OF3N3C18H20 AB3C3D18E20 -165.73 7.21 -9.94 -1.14 0
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141370 52869400 1 OF3N3C18H20 AB3C3D18E20 -165.17 7.11 -10.0 -1.14 0
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141371 52869401 1 NOF3C14H18 ABC3D14E18 -215.64 6.27 -10.01 -0.63 0
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141372 52869433 1 O2F3N3C17H20 A2B3C3D17E20 -216.26 1.45 -9.54 -0.74 0
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141373 52869593 1 S2N4O6H16C17 A2B4C6D16E17 -111.92 8.26 -9.21 -1.68 0
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141374 52870173 1 O2N5C24H31 A2B5C24D31 -16.77 8.16 -9.02 -0.58 0
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141375 52870272 1 N3O3C20H31 A3B3C20D31 -124.38 2.35 -8.64 0.34 1
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141376 52870551 1 Cl2O2N4C21H29 A2B2C4D21E29 -32.34 6.2 0.0 0.0 0
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141377 52870552 1 Cl2O2N4C21H28 A2B2C4D21E28 -41.99 5.18 -8.88 -1.26 0
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141378 52870992 1 SO2N5C17H17 AB2C5D17E17 20.22 7.69 -8.95 -0.9 0
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141379 52871322 1 FN2O3H13C14 AB2C3D13E14 -98.28 8.15 -8.81 -0.7 0
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141380 52871455 1 O4N6C25H30 A4B6C25D30 -143.57 2.77 -8.78 -1.35 1
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141381 52871637 1 N3O3C18H22 A3B3C18D22 -63.89 4.1 0.0 0.0 0
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141382 52871676 1 SO2N3C18H21 AB2C3D18E21 -43.51 4.2 -8.82 -0.56 1
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141383 52871677 1 SO2N3C18H22 AB2C3D18E22 -15.06 1.22 0.0 0.0 0
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141384 52871678 1 SO2N3C18H21 AB2C3D18E21 -46.09 7.43 -8.66 -0.11 1
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141385 52871679 1 ClFO2N3C19H20 ABC2D3E19F20 -80.43 4.72 0.0 0.0 0
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141386 52871680 1 ClFO2N3C19H19 ABC2D3E19F19 -96.18 7.5 -8.85 -0.68 0
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141387 52871878 1 FSO2N3C26H26 ABC2D3E26F26 -80.21 8.46 -8.75 -1.15 0