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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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89899 49965295 1 ClSN2O6H17C22 ABC2D6E17F22 -117.93 10.19 -9.55 -1.8 0
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89900 49965296 1 NSCl2O5H15C21 ABC2D5E15F21 -149.74 8.1 -9.23 -1.61 0
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89901 49965297 1 N3O4C21H21 A3B4C21D21 -58.72 15.53 -8.15 -2.54 1
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89902 49965298 1 N3O4C21H22 A3B4C21D22 -68.97 4.34 0.0 0.0 0
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89903 49965299 1 S2N3O3H13C19 A2B3C3D13E19 -27.86 5.75 -9.28 -1.74 0
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89904 49965308 1 N2O2S2H12C19 A2B2C2D12E19 33.81 2.61 -8.97 -1.64 0
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89905 49965311 1 SO4N5C21H21 AB4C5D21E21 -57.08 9.33 -8.09 -1.04 0
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89906 49965317 1 S2F3N3O4H14C18 A2B3C3D4E14F18 -268.4 6.34 -9.01 -1.77 0
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89907 49965324 1 S3N4O6H16C19 A3B4C6D16E19 -166.66 2.68 -9.36 -2.13 0
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89908 49965330 1 SO2N3H15C20 AB2C3D15E20 18.86 4.45 -8.48 -1.48 0
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89909 49965332 1 S2O3N4H22C24 A2B3C4D22E24 -53.57 4.99 -8.27 -1.64 0
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89910 49965335 1 S2N3O6H15C18 A2B3C6D15E18 -166.84 2.57 -9.06 -1.69 0
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89911 49965336 2 SO2N3H5C6 AB2C3D5E6 -67.35 10.09 -9.11 -1.6 0
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89912 49965339 1 S2N3O4C22H27 A2B3C4D22E27 -165.22 4.25 -9.03 -1.67 0
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89913 49965342 1 OS2N5H25C27 AB2C5D25E27 64.28 3.34 -8.5 -1.27 0
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89914 49965345 1 ClO3N4H15C21 AB3C4D15E21 -4.44 4.8 -8.9 -1.34 0
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89915 49965346 1 S2N3O8H19C20 A2B3C8D19E20 -261.77 2.81 -8.66 -1.94 0
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89916 49965352 1 S2O3N6H20C25 A2B3C6D20E25 72.38 12.18 -8.8 -1.63 0
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89917 49965357 1 N2S2O5C13H14 A2B2C5D13E14 -186.43 5.45 -9.03 -1.69 0
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89918 49965358 2 NSO3H7C9 ABC3D7E9 -167.47 7.56 -8.87 -1.52 0
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89919 49965380 1 OS2N6H18C20 AB2C6D18E20 86.78 7.24 -8.64 -1.37 0
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89920 49965381 1 S2O3N5H25C27 A2B3C5D25E27 -30.46 8.23 -8.75 -1.61 0
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89921 49965393 1 SO3N5C26H31 AB3C5D26E31 -86.56 5.14 -8.36 -1.07 0
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89922 49965396 1 ClOSF3N4H20C25 ABCD3E4F20G25 -124.18 7.48 -8.62 -1.39 0
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89923 49965400 1 ClS2N3O6H16C18 AB2C3D6E16F18 -185.25 4.54 -8.55 -1.9 0
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89924 49965403 1 SN3O3H25C26 AB3C3D25E26 -18.42 7.01 -8.3 -1.04 0
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89925 49965406 1 OSCl2N4H20C24 ABC2D4E20F24 24.76 7.36 -8.6 -1.35 0
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89926 49965408 1 ClFOSN4H20C24 ABCDE4F20G24 -6.9 5.67 -8.46 -1.21 0
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89927 49965409 1 OS2N4C14H14 AB2C4D14E14 49.34 7.2 -8.92 -0.81 0
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89928 49965410 1 ClS2N3O4H14C17 AB2C3D4E14F17 -120.39 5.35 -9.0 -1.66 0
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89929 49965411 1 ClS2F3N3O4H11C17 AB2C3D3E4F11G17 -271.91 3.22 -9.09 -1.94 0
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89930 49965412 2 SN2O3H6C8 AB2C3D6E8 -103.18 3.79 -9.18 -1.93 0
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89931 49965413 1 SN3C21H25 AB3C21D25 62.18 5.37 -8.73 -0.82 0
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89932 49965415 1 BrOSN4H23C25 ABCD4E23F25 36.53 6.25 -8.46 -1.25 0
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89933 49965419 1 ClOSN4H23C25 ABCD4E23F25 29.08 5.78 -8.46 -1.2 0
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89934 49965420 1 OS2N4H24C25 AB2C4D24E25 48.16 6.2 -8.51 -1.12 0
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89935 49965431 1 ClSO3N4H25C26 ABC3D4E25F26 -40.69 6.37 -8.0 -1.19 0
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89936 49965441 1 ClFOSN4H20C24 ABCDE4F20G24 -10.55 7.35 -8.55 -1.31 0
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89937 49965450 1 ClSO3N4H17C21 ABC3D4E17F21 -24.95 7.17 -8.52 -1.62 0
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89938 49965456 1 SN3C19H19 AB3C19D19 100.03 5.69 -8.77 -0.85 0
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89939 49965460 1 OF2N2H12C20 AB2C2D12E20 -23.12 4.97 -8.92 -0.85 0
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89940 49965484 1 BrSO2N5H12C17 ABC2D5E12F17 31.82 12.33 -8.99 -1.24 0
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89941 49965496 1 N4O4C19H20 A4B4C19D20 -73.51 7.84 -8.23 -1.33 0
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89942 49965497 1 ClSO3N5H18C24 ABC3D5E18F24 7.45 11.96 -8.93 -1.18 1
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89943 49965528 1 N2O3C15H15 A2B3C15D15 -69.26 2.51 0.0 0.0 0
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89944 49965529 1 F2N2O2S2H8C13 A2B2C2D2E8F13 -98.27 5.14 -8.97 -1.31 0
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89945 49965531 1 Cl2S2N3O3H9C14 A2B2C3D3E9F14 -61.23 4.83 -9.11 -1.49 0
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89946 49965558 1 FNO4H14C18 ABC4D14E18 -134.92 5.97 -9.39 -1.08 0
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89947 49965572 1 N3O4C22H23 A3B4C22D23 -51.13 4.98 -8.51 -1.74 0
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89948 49965574 2 ON2H8C9 AB2C8D9 29.65 4.88 -8.61 -0.5 0
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89949 49965575 1 BrO3N4C14H15 AB3C4D14E15 -49.44 9.84 -9.04 -1.02 0
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89950 49965576 1 SO3N4H20C25 AB3C4D20E25 48.87 8.14 -9.18 -1.41 0
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89951 49965577 1 SO2F3N4C17H17 AB2C3D4E17F17 -138.2 8.01 -9.53 -1.79 -1
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89952 49965584 1 FSN3O3C20H21 ABC3D3E20F21 -9.19 6.71 0.0 0.0 0
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89953 49965585 1 SN3O3C20H21 AB3C3D20E21 -28.01 7.47 -9.35 -0.9 0
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89954 49965588 1 N3O3C19H23 A3B3C19D23 -104.05 5.19 -8.58 -0.48 0
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89955 49965589 1 SN3O4C19H23 AB3C4D19E23 -64.91 7.0 -9.44 -1.06 0
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89956 49965592 1 N2S2O7C19H22 A2B2C7D19E22 -217.48 11.1 -8.27 -0.9 1
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89957 49965593 1 SN2O3C18H19 AB2C3D18E19 -53.18 5.47 0.0 0.0 0
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89958 49965596 1 SO4N6H12C17 AB4C6D12E17 26.43 10.24 -8.98 -1.2 0
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89959 49965604 1 N3O8C30H33 A3B8C30D33 -196.55 7.28 -8.28 -0.44 0
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89960 49965607 1 O3N5H13C15 A3B5C13D15 -2.47 3.65 -9.31 -0.42 0
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89961 49965611 1 O6N7H19C21 A6B7C19D21 -18.56 11.17 -9.15 -1.12 0
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89962 49965612 1 N2O5H20C23 A2B5C20D23 -113.44 9.3 -9.44 -0.82 0
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89963 49965621 1 SO4N5H21C25 AB4C5D21E25 -18.95 9.97 -8.08 -1.12 0
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89964 49965626 1 N3O7C30H35 A3B7C30D35 -151.83 5.64 -7.98 -0.14 0
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89965 49965638 2 N2O2H7C8 A2B2C7D8 -60.53 4.9 -8.58 -1.17 0
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89966 49965639 1 SO4N5C22H23 AB4C5D22E23 -63.1 11.52 -7.92 -1.07 0
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89967 49965672 1 N3O9C34H43 A3B9C34D43 -280.06 1.35 -8.76 -1.07 0
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89968 49965677 1 N3O5C40H53 A3B5C40D53 -110.13 4.78 -8.5 -0.66 0
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89969 49965678 1 N3O5C35H51 A3B5C35D51 -134.9 4.78 -8.36 -0.56 0
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89970 49965679 1 N3O5C36H53 A3B5C36D53 -141.9 2.01 -8.3 -0.65 0
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89971 49965681 1 ON3Cl4H17C23 AB3C4D17E23 45.87 7.1 -8.92 -0.58 0
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89972 49965683 1 N3O3C35H37 A3B3C35D37 -4.68 6.33 -8.62 -0.22 0
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89973 49965697 1 ON3Cl4H21C29 AB3C4D21E29 72.08 6.72 -8.9 -0.78 0