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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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162979 57581169 1 O2N5H9C10 A2B5C9D10 36.87 3.92 -9.66 -1.19 0
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162980 57581194 1 ClO2N4C23H25 AB2C4D23E25 8.27 4.8 -8.52 -0.72 0
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162981 57581207 1 FN2C6H13 AB2C6D13 -47.33 0.87 -8.97 2.04 0
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162982 57581211 1 Cl2O2N4C23H24 A2B2C4D23E24 6.81 5.6 -8.69 -0.97 0
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162983 57581213 1 ON2C7H16 AB2C7D16 -36.81 2.0 -8.06 2.28 0
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162984 57581219 1 SO2N3C11H17 AB2C3D11E17 -35.7 4.56 -8.21 -0.57 0
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162986 57581235 1 NSO3H27C29 ABC3D27E29 -36.55 3.42 -8.68 -0.77 0
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162987 57581238 1 SN2O3H26C28 AB2C3D26E28 -34.17 5.75 -8.69 -0.66 0
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162988 57581241 1 SN2O3H24C28 AB2C3D24E28 -21.99 2.48 -8.88 -0.72 0
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162989 57581242 1 N2O2H26C29 A2B2C26D29 -0.15 1.1 -9.07 -0.63 0
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162990 57581245 2 O2C7H8 A2B7C8 -175.06 9.92 -9.49 -0.92 0
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162991 57581248 1 N2O5H28C32 A2B5C28D32 -119.62 6.12 -9.16 -0.76 0
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162992 57581249 1 N2O7H30C31 A2B7C30D31 -190.21 5.18 -8.58 -0.87 0
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162993 57581250 1 N3O3H25C31 A3B3C25D31 1.75 1.93 -9.16 -0.77 0
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162995 57581276 1 N3O3H23C28 A3B3C23D28 -12.78 4.23 -9.18 -0.86 0
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162996 57581300 1 ON2C16H20 AB2C16D20 -12.7 2.34 -8.84 -0.18 0
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162997 57581304 1 N2O5H28C29 A2B5C28D29 -103.61 13.02 -8.07 -1.3 -1
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162998 57581316 1 O3C16H21 A3B16C21 -87.08 3.52 0.0 0.0 0
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162999 57581324 1 N3O6C34H37 A3B6C34D37 -172.92 2.95 -8.62 -0.57 0
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163000 57581328 1 N2O4C33H40 A2B4C33D40 -109.0 5.91 -8.69 -0.69 0
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163001 57581331 1 SiO2N3C22H27 AB2C3D22E27 -41.07 2.79 -9.04 -0.14 0
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163002 57581332 1 NO4H15C17 AB4C15D17 -36.75 4.94 -9.94 -1.56 0
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163004 57581337 1 N2O4C31H32 A2B4C31D32 -74.16 4.74 -8.41 -0.34 -1
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163005 57581342 1 O5C14H19 A5B14C19 -153.42 3.72 0.0 0.0 0
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163006 57581343 1 O5C14H20 A5B14C20 -206.95 4.47 -9.04 -0.1 0
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163007 57581354 1 N2O6C31H32 A2B6C31D32 -151.07 1.61 -8.52 -0.62 0
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163008 57581358 1 SiN2O2C23H26 AB2C2D23E26 -55.19 2.47 -9.21 -0.57 0
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163009 57581359 2 NO3H15C16 AB3C15D16 -152.41 6.2 -8.59 -1.09 0
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163010 57581362 1 NSO5C33H33 ABC5D33E33 -143.0 3.97 -8.48 -0.67 0
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163011 57581367 1 SN2O4H26C29 AB2C4D26E29 -58.81 2.31 -8.82 -0.67 0
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163012 57581368 1 N3O4H29C32 A3B4C29D32 -38.53 4.33 -8.57 -0.97 0
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163013 57581369 1 NF3O3H18C21 AB3C3D18E21 -231.29 1.76 -8.93 -1.09 0
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163014 57581370 1 N3O3H23C30 A3B3C23D30 8.67 3.69 -9.18 -0.98 0
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163015 57581373 2 NO3H15C16 AB3C15D16 -151.48 3.92 -8.56 -1.0 0
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163016 57581378 1 N3O4H27C28 A3B4C27D28 -61.74 5.56 -8.83 -0.92 0
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163017 57581380 1 NSO2H19C20 ABC2D19E20 -28.96 0.75 -8.6 -0.3 0
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163018 57581381 1 N2O3H24C29 A2B3C24D29 -23.28 2.76 -9.08 -0.64 0
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163019 57581387 1 N3O4C33H35 A3B4C33D35 -69.12 5.62 -8.24 -0.47 0
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163020 57581389 1 SN2O2H28C30 AB2C2D28E30 -4.02 5.69 -8.63 -0.72 0
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163021 57581401 1 NF3O3H14C19 AB3C3D14E19 -222.64 5.82 -9.16 -1.08 0
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163023 57581404 1 ON2C13H14 AB2C13D14 3.22 2.01 -8.84 -0.25 0
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163024 57581405 1 NSO3H27C29 ABC3D27E29 -39.23 2.2 -8.71 -0.69 0
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163025 57581406 1 NO5H13C15 AB5C13D15 -67.56 3.94 -9.46 -1.54 0
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163027 57581409 1 NO6C29H31 AB6C29D31 -198.52 7.28 -8.64 -0.6 0
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163028 57581412 1 ON2H16C18 AB2C16D18 37.7 3.03 -8.87 -0.23 0
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163029 57581414 1 N3O7C36H41 A3B7C36D41 -224.52 9.16 -8.69 -0.76 0
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163030 57581417 1 N2O4H28C31 A2B4C28D31 -71.37 11.98 -7.34 -1.14 0
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163031 57581418 1 N2O2H12C17 A2B2C12D17 12.42 4.81 -9.76 -1.43 0
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163032 57581428 2 NO3C18H19 AB3C18D19 -177.07 4.45 -8.81 -1.05 0
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163033 57581432 1 N2O5H26C30 A2B5C26D30 -91.18 13.24 -7.29 -1.13 0