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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148224 53787886 1 N2O7C22H29 A2B7C22D29 -245.25 9.47 0.0 0.0 0
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148225 53787887 1 ClS2N5O7H20C21 AB2C5D7E20F21 -175.24 1.62 -9.31 -1.72 0
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148226 53787888 1 SN2O5H14C15 AB2C5D14E15 -133.06 7.95 -9.52 -0.84 0
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148227 53787889 1 O4H28C31 A4B28C31 -58.84 2.96 -8.53 -0.85 0
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148228 53787890 1 FSO3N7H26C29 ABC3D7E26F29 -12.61 8.28 -8.99 -0.87 0
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148229 53787891 1 NOC19H19 ABC19D19 41.53 5.23 -8.24 -0.72 0
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148230 53787892 1 N2S2C7H16 A2B2C7D16 -2.04 4.42 -8.55 -0.29 0
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148231 53787893 1 NO7C30H37 AB7C30D37 -227.96 5.06 -8.54 -0.28 0
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148232 53787894 1 SF2N2C8H8 AB2C2D8E8 -45.84 2.75 -8.09 -0.7 0
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148233 53787895 1 O6C25H32 A6B25C32 -231.81 4.9 -8.94 -0.2 0
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148234 53787896 1 ClN2O3C17H25 AB2C3D17E25 -143.28 6.01 -8.98 -0.28 0
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148235 53787897 1 N4O7C18H22 A4B7C18D22 -179.89 4.09 -9.85 -1.88 0
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148236 53787898 1 N2O6H28C29 A2B6C28D29 -143.8 4.92 -9.27 -0.67 0
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148237 53787899 1 IN2S2O4H17C21 AB2C2D4E17F21 -61.82 6.13 -9.39 -1.17 0
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148238 53787900 1 IN2S2O4H17C21 AB2C2D4E17F21 -60.53 6.89 -9.3 -1.09 0
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148239 53787901 1 O4N5C21H33 A4B5C21D33 -2.84 4.28 -8.91 -1.31 0
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148240 53787902 1 O4N5C15H15 A4B5C15D15 43.44 6.38 -8.87 -1.11 1
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148241 53787903 1 ON2H13C16 AB2C13D16 77.54 1.5 0.0 0.0 0
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148242 53787904 1 SN3O4C24H31 AB3C4D24E31 -137.92 8.34 -9.45 -0.74 1
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148243 53787905 1 SCl2N3O6C19H20 AB2C3D6E19F20 -149.01 1.76 0.0 0.0 0
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148244 53787906 1 ON6C20H32 AB6C20D32 15.84 7.49 -9.87 -0.82 0
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148245 53787907 1 O6C27H28 A6B27C28 -137.1 5.27 -9.01 -0.58 0
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148246 53787908 1 NCl2O2H9C11 AB2C2D9E11 -18.73 2.29 -9.61 -0.72 0
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148247 53787909 1 N2O3C22H26 A2B3C22D26 -46.18 2.05 -8.24 -0.38 0
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148248 53787910 1 N4O5C28H32 A4B5C28D32 -135.73 7.51 -7.96 -0.39 0
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148249 53787911 2 PO4C5H8 AB4C5D8 -441.47 3.12 -9.39 -0.21 0
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148250 53787912 1 N2O2C29H42 A2B2C29D42 -87.65 3.16 -8.43 -0.73 0
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148251 53787913 1 NOC21H21 ABC21D21 48.19 2.18 -8.77 -0.57 0
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148252 53787914 1 FOSN2C15H15 ABCD2E15F15 -22.02 6.25 -9.14 -0.63 -1
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148253 53787915 1 N2O2C7H15 A2B2C7D15 -80.95 2.51 0.0 0.0 0
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148254 53787916 1 N2O2C7H16 A2B2C7D16 -98.42 4.8 -9.26 0.81 0
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148255 53787917 1 NSO3C5H7 ABC3D5E7 -92.07 4.24 -8.88 -0.08 0
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148256 53787918 1 O5C17H22 A5B17C22 -200.13 5.58 -9.67 -0.72 0
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148257 53787919 1 N2O3C8H14 A2B3C8D14 -30.4 0.8 -9.42 -0.99 0
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148258 53787920 1 PSN2O4C19H23 ABC2D4E19F23 -172.6 6.2 -8.89 -0.6 0
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148259 53787921 1 Cl2O3N4C13H18 A2B3C4D13E18 -101.59 3.56 -8.88 -0.76 0
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148260 53787922 1 FSN3O6C18H20 ABC3D6E18F20 -254.56 8.54 -9.56 -0.54 0
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148261 53787923 1 NPO4C10H22 ABC4D10E22 -272.32 3.87 -9.69 0.75 0
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148262 53787924 1 ClN2O3C21H23 AB2C3D21E23 -69.88 3.55 -8.58 -1.3 0
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148263 53787925 1 OC27H42 AB27C42 -81.79 3.36 -8.34 0.2 0
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148264 53787926 1 PN2F3O3C22H22 AB2C3D3E22F22 -266.75 7.37 -9.23 -1.54 0
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148265 53787927 1 ClO2H9C11 AB2C9D11 -30.65 3.05 -9.52 -0.75 0
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148266 53787928 1 P2O7Cl9C17H29 A2B7C9D17E29 -532.41 2.77 -10.36 -0.28 0
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148267 53787929 1 OSN2C5H8 ABC2D5E8 -26.06 4.66 -9.06 0.13 0
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148268 53787930 1 NH13C14 AB13C14 43.9 1.95 -7.8 -0.3 0
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148269 53787931 1 OSN3C4H5 ABC3D4E5 -5.78 6.53 -9.35 -0.68 0
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148270 53787932 1 ClNSO2C13H22 ABCD2E13F22 -109.6 3.96 -9.78 -0.75 0
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148271 53787933 1 N2S2O4C19H28 A2B2C4D19E28 -150.59 6.58 -9.17 -1.43 0
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148272 53787934 1 O2N3C34H57 A2B3C34D57 -123.75 3.59 -8.34 -0.01 0
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148273 53787935 1 N2O4C41H50 A2B4C41D50 -85.63 3.9 -8.66 -0.05 0