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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193289 78370766 1 N3O3H19C21 A3B3C19D21 -26.89 3.19 -9.37 -1.24 0
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193290 78370844 1 SO2N4C21H30 AB2C4D21E30 -56.35 7.58 -8.8 -0.54 1
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193291 78370968 1 O2N3C21H22 A2B3C21D22 -0.11 3.39 0.0 0.0 0
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193292 78370969 1 ClN2O4C25H25 AB2C4D25E25 -106.7 2.21 -8.84 -1.32 0
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193293 78371904 1 BrN2S2H7C12 AB2C2D7E12 119.21 3.21 -9.2 -2.13 1
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193294 78372670 1 SO2N3C20H26 AB2C3D20E26 -16.88 13.82 0.0 0.0 2
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193295 78372800 1 N3O5C25H37 A3B5C25D37 -177.95 2.25 -8.64 -0.01 0
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193296 78372962 1 SN3O4H17C18 AB3C4D17E18 -98.18 2.65 -9.27 -1.74 0
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193297 78373201 1 OSF3N3H12C18 ABC3D3E12F18 -75.35 4.65 -9.36 -1.88 0
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193298 78373335 1 N3O6C32H35 A3B6C32D35 -130.61 16.15 -8.12 -0.58 0
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193299 78373520 1 IO3N4H11C17 AB3C4D11E17 52.48 6.44 -9.13 -1.75 0
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193300 78373903 1 O4N5C20H27 A4B5C20D27 -140.07 1.53 -9.07 -0.06 0
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193301 78373904 1 SN2O5C9H12 AB2C5D9E12 -179.88 4.97 -9.87 -1.63 0
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193302 78373905 1 O4N5C21H21 A4B5C21D21 22.73 8.35 -9.3 -1.33 0
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193303 78373906 1 O3N4C26H32 A3B4C26D32 -66.68 3.78 -9.1 -0.14 0
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193304 78373907 2 N2O3H6C7 A2B3C6D7 -37.05 4.64 -10.0 -1.62 1
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193305 78373908 1 N5O6C23H28 A5B6C23D28 -196.22 2.46 0.0 0.0 0
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193306 78374306 2 OSN4C5H8 ABC4D5E8 -2.26 8.94 -8.85 -0.89 0
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193307 78374307 1 S2N6O6C29H36 A2B6C6D29E36 -199.43 4.13 -8.6 -1.0 0
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193308 78374308 1 N4O4H18C21 A4B4C18D21 -39.52 3.49 -8.32 -1.51 0
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193309 78374309 1 SCl2N2O5H14C15 AB2C2D5E14F15 -174.75 4.86 -8.89 -1.61 0
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193310 78374310 1 S2O3N5C22H23 A2B3C5D22E23 -48.46 3.18 -8.81 -1.01 0
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193311 78374403 1 ClO2N4C7H7 AB2C4D7E7 -19.05 2.59 -10.43 -2.07 0
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193312 78374720 1 ClN2O5C28H39 AB2C5D28E39 -223.78 4.01 -9.39 -0.12 1
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193313 78374721 1 N2O2C15H19 A2B2C15D19 -37.82 3.66 0.0 0.0 1
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193314 78374722 1 ON2C17H23 AB2C17D23 -1.09 12.39 0.0 0.0 0
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193315 78374983 1 SN3O3C26H31 AB3C3D26E31 -98.47 4.29 -8.81 -0.39 0
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193316 78375182 1 FSN2O2C20H23 ABC2D2E20F23 -90.71 2.69 -8.72 -0.82 0
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193317 78375394 1 SO3N4C19H26 AB3C4D19E26 -61.07 3.57 -8.97 -1.89 1
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193318 78375395 1 SO3N4C19H27 AB3C4D19E27 -64.84 13.83 0.0 0.0 -1
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193319 78375626 1 SN3O4H10C11 AB3C4D10E11 -63.38 5.91 0.0 0.0 1
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193320 78375627 1 O2N3C11H14 A2B3C11D14 -21.7 13.08 0.0 0.0 0
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193321 78375684 1 ClO2N5C23H24 AB2C5D23E24 -16.85 5.7 -8.9 -0.32 0
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193322 78375685 1 O4N5C19H23 A4B5C19D23 -114.03 5.07 -8.91 -0.32 2
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193323 78375686 1 O4N5C20H23 A4B5C20D23 -113.22 5.33 -8.61 -0.65 0
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193324 78375935 1 ClSN4O4H23C27 ABC4D4E23F27 -29.15 7.93 -8.37 -2.02 0
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193325 78375936 1 SN2O4C16H22 AB2C4D16E22 -112.79 4.34 -8.72 -1.57 0
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193326 78375937 1 SN2O4C18H18 AB2C4D18E18 -64.78 6.44 -8.72 -1.58 0
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193327 78376301 1 N2O2H12C15 A2B2C12D15 19.0 4.56 -9.11 -2.01 0
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193328 78376302 1 BrON6H7C10 ABC6D7E10 106.64 5.52 -9.66 -1.96 0
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193329 78376303 1 OSF3N4H11C12 ABC3D4E11F12 -105.63 7.21 -9.0 -1.05 0
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193330 78376325 1 BrO2N4C20H23 AB2C4D20E23 12.79 7.97 -8.9 -0.27 0
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193331 78376395 1 KON2S2H9C10 ABC2D2E9F10 -42.84 7.94 -8.01 -0.53 0
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193332 78376464 1 ClNO5C29H32 ABC5D29E32 -158.04 1.28 -8.42 -1.03 0
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193333 78377309 1 N5C16H23 A5B16C23 67.48 2.0 -8.7 0.22 0
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193334 78377442 1 ClSO2N4H9C13 ABC2D4E9F13 36.85 4.28 -9.73 -1.64 0
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193335 78377443 1 FN2O4C27H37 AB2C4D27E37 -223.99 1.34 -9.52 -0.27 0
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193336 78377444 1 F2N2O5C30H34 A2B2C5D30E34 -249.75 2.2 -9.29 -0.3 0
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193337 78377790 1 N2O3C28H32 A2B3C28D32 -81.07 1.9 -9.06 -1.06 0
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193338 78377791 1 NO7H31C32 AB7C31D32 -206.27 4.14 -9.05 -0.82 1