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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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449506 135299152 1 N2O4C11H14 A2B4C11D14 -116.12 1.35 -8.7 -0.86 0
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449508 135299160 1 NO4C15H31 AB4C15D31 -198.77 3.29 -8.88 0.52 0
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449509 135299170 1 SN3O4C28H39 AB3C4D28E39 -183.34 1.54 -8.91 -0.45 0
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449510 135299173 1 N2O3C27H28 A2B3C27D28 -55.36 7.43 -8.38 -0.42 0
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449511 135299180 1 NO3H23C25 AB3C23D25 -71.13 5.88 -8.78 -0.55 0
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449512 135299181 1 NO2C10H13 AB2C10D13 -70.18 4.66 -8.64 0.03 0
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449513 135299190 1 P2S2N3O10C21H41 A2B2C3D10E21F41 -614.79 5.53 -9.35 -0.28 0
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449519 135299234 2 SO2C5H8 AB2C5D8 -189.07 5.53 -8.38 -1.03 0
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449520 135299249 1 SO7C14H22 AB7C14D22 -334.96 4.08 -9.44 0.13 0
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449521 135299255 1 N2S2O9C23H34 A2B2C9D23E34 -298.3 11.09 -8.38 -1.44 0
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449522 135299289 1 SN2O6H24C32 AB2C6D24E32 -37.45 5.48 -8.81 -1.77 0
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449523 135299299 1 N2O3C29H36 A2B3C29D36 -88.94 4.83 -7.98 -0.07 0
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449524 135299307 1 N2O3C34H42 A2B3C34D42 -56.84 3.27 -7.98 -0.06 0
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449525 135299308 1 O3C17H26 A3B17C26 -157.78 6.37 -10.77 -0.13 0
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449526 135299328 1 N2O3H32C34 A2B3C32D34 2.52 4.48 -9.42 -0.8 0
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449527 135299335 1 O2C19H22 A2B19C22 -51.0 2.18 -9.29 0.05 0
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449528 135299339 1 N2C23H34 A2B23C34 8.48 1.47 -8.47 0.32 0
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449529 135299346 1 N2C13H28 A2B13C28 -43.01 1.9 -8.45 2.76 1
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449530 135299349 1 OPN2C35H48 ABC2D35E48 -20.01 11.02 0.0 0.0 0
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449531 135299354 1 NO5C27H49 AB5C27D49 -276.21 4.6 -9.1 -0.19 0
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449532 135299358 1 SN2O2C15H24 AB2C2D15E24 -73.65 5.67 -8.37 -0.55 0
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449533 135299360 1 OCl2N2C21H24 AB2C2D21E24 -35.8 3.73 -8.79 -0.82 0
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449534 135299363 1 N2O2C15H24 A2B2C15D24 -89.35 3.28 -8.22 0.25 0
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449535 135299367 1 NH27C40 AB27C40 163.32 0.32 -8.03 -0.63 0
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449536 135299382 1 NH35C52 AB35C52 223.17 1.53 -8.24 -0.58 0