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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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195295 78670399 1 ClON3C21H27 ABC3D21E27 19.82 4.93 0.0 0.0 0
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195296 78670594 1 N2O5C18H26 A2B5C18D26 -228.6 3.03 -8.81 -0.19 0
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195297 78670871 1 NO4C19H21 AB4C19D21 -137.48 4.56 -8.94 -0.24 0
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195298 78670872 1 SN2F3O5C14H19 AB2C3D5E14F19 -355.22 6.66 -9.25 -0.83 1
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195299 78670873 1 F2O2N3C21H26 A2B2C3D21E26 -114.59 6.46 0.0 0.0 0
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195300 78670874 1 F2O2N3C21H25 A2B2C3D21E25 -125.21 1.68 -8.49 -0.34 0
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195301 78670875 1 NO5C20H23 AB5C20D23 -174.9 3.93 -8.32 -0.14 1
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195302 78671010 1 SN2O5C18H27 AB2C5D18E27 -162.99 5.64 0.0 0.0 0
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195303 78671011 1 SN2O5C18H26 AB2C5D18E26 -183.15 3.98 -8.47 -0.01 1
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195304 78671012 1 O2N4C25H35 A2B4C25D35 -26.01 5.5 0.0 0.0 1
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195305 78671013 1 N2O4C22H27 A2B4C22D27 -93.49 1.95 0.0 0.0 0
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195306 78671341 1 Cl2N2O3C19H22 A2B2C3D19E22 -104.45 2.49 -7.92 -0.66 0
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195307 78671801 1 N3O4C21H25 A3B4C21D25 -100.74 6.87 -8.38 -0.34 0
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195308 78671802 1 O2N5C23H27 A2B5C23D27 26.24 13.13 -8.37 -0.62 0
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195309 78671803 1 ON5C23H27 AB5C23D27 62.94 9.67 -8.18 -0.26 0
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195310 78672077 1 N4O5C18H22 A4B5C18D22 -160.64 6.11 -9.66 -1.81 0
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195311 78672336 1 FN2O4C23H23 AB2C4D23E23 -146.3 2.02 -9.52 -1.22 0
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195312 78672337 1 NSO5C15H21 ABC5D15E21 -197.33 2.01 -10.1 -0.82 1
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195313 78672338 1 O2N3C23H30 A2B3C23D30 -33.78 5.88 0.0 0.0 0
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195314 78672339 1 O2N3C23H29 A2B3C23D29 -59.99 4.75 -8.6 -0.54 0
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195315 78672340 1 NSO4C15H23 ABC4D15E23 -172.95 6.01 -9.73 -0.44 1
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195316 78672341 1 OSN3C23H28 ABC3D23E28 42.65 5.87 0.0 0.0 0
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195317 78672374 1 SN2F3O3H15C17 AB2C3D3E15F17 -188.67 5.13 -9.35 -1.12 0
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195318 78672375 1 OS2N4C16H22 AB2C4D16E22 7.87 6.27 -8.57 -1.02 0
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195319 78672376 2 OSN2C10H11 ABC2D10E11 14.3 6.11 -8.28 -1.03 0
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195320 78672377 2 OSN2C7H9 ABC2D7E9 -16.37 7.4 -8.62 -1.07 0
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195321 78672378 1 N3O7C17H19 A3B7C17D19 -244.31 1.16 -8.44 -0.25 0
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195322 78672379 1 ClNO5C20H20 ABC5D20E20 -172.39 4.33 -9.63 -0.67 0
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195323 78672380 1 FN2O6H19C21 AB2C6D19E21 -238.35 4.59 -8.23 -0.54 0
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195324 78672381 1 FOS2N4C13H15 ABC2D4E13F15 -23.32 10.21 -8.65 -1.19 0
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195325 78672382 1 NO5C24H29 AB5C24D29 -183.78 6.79 -9.43 -0.53 0
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195326 78672383 1 N3O7C20H25 A3B7C20D25 -289.25 2.29 -8.4 -0.29 0
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195327 78673015 1 SO2N3C23H27 AB2C3D23E27 -48.79 3.17 -9.02 -0.83 0
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195328 78673016 1 NO3H19C21 AB3C19D21 -37.5 6.43 -9.84 -1.36 0
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195329 78673017 1 NO3H21C22 AB3C21D22 -42.87 6.54 -9.85 -1.28 0
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195330 78673852 2 NSC5O5H9 ABC5D5E9 -397.43 2.74 -9.36 -0.64 0
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195331 78673861 1 BrON2C14H21 ABC2D14E21 -42.78 3.73 -9.0 -0.67 0
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195332 78674357 1 BrO2N3C20H26 AB2C3D20E26 -39.51 4.43 -8.12 -0.17 1
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195333 78674358 1 OSN3C22H28 ABC3D22E28 40.17 3.4 0.0 0.0 0
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195334 78674498 1 SN4O5C18H22 AB4C5D18E22 -144.45 2.31 -9.05 -1.35 0
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195335 78674618 1 N2O4C23H28 A2B4C23D28 -97.35 1.94 -8.1 -0.63 0
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195336 78674880 1 SO3N4C20H26 AB3C4D20E26 -66.7 3.92 -8.63 -0.59 0
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195337 78674946 1 SN2O3C22H26 AB2C3D22E26 -78.34 10.21 -8.36 -0.76 0
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195338 78675290 1 ClN3O5C20H24 AB3C5D20E24 -203.11 6.92 -9.6 -1.1 0
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195339 78675471 1 SN3O3C22H25 AB3C3D22E25 -82.69 3.82 -8.3 -1.0 1
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195340 78675541 1 NO2C18H26 AB2C18D26 -49.13 5.7 0.0 0.0 0
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195341 78675688 1 SO3N5H17C19 AB3C5D17E19 46.64 2.35 -9.62 -1.95 0
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195342 78675730 1 OS2N5C18H23 AB2C5D18E23 38.26 13.02 -8.24 -1.32 0
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195343 78675748 1 S2N3O3C18H21 A2B3C3D18E21 -38.56 6.57 -8.75 -1.01 0
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195344 78675870 1 NO3H19C23 AB3C19D23 -39.73 1.72 -8.9 -1.14 0