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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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434411 135174892 1 SN8O8C53H58 AB8C8D53E58 -149.36 10.78 -8.79 -0.93 0
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434412 135174893 1 SN7O7C48H59 AB7C7D48E59 -164.9 3.32 -8.34 -0.54 0
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434413 135174895 1 PO3C18H37 AB3C18D37 -271.31 2.11 -9.9 1.29 0
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434414 135174898 1 N3O6C16H25 A3B6C16D25 -240.91 8.1 -9.64 -1.77 0
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434415 135174899 1 O2N5C23H29 A2B5C23D29 -11.02 7.96 -8.96 -1.53 0
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434416 135174900 1 O3N4C33H56 A3B4C33D56 -154.23 3.64 -8.52 -0.21 0
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434417 135174903 1 NOSC15H33 ABCD15E33 -100.32 2.35 -8.59 0.68 0
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434418 135174904 1 NO2C13H29 AB2C13D29 -134.11 1.32 -8.94 1.63 0
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434419 135174905 1 F2S2N7O8C50H53 A2B2C7D8E50F53 -313.18 10.94 -8.82 -0.92 0
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434420 135174906 1 N2O4C33H66 A2B4C33D66 -283.46 1.57 -8.49 2.24 0
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434421 135174907 1 SN2O6C14H18 AB2C6D14E18 -221.12 4.88 -9.78 -1.64 0
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434422 135174908 1 N2O2C23H42 A2B2C23D42 -103.04 2.63 -8.19 0.63 0
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434423 135174909 1 ON3C26H47 AB3C26D47 -84.06 2.75 -8.11 0.48 0
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434424 135174910 1 NS2O3C12H23 AB2C3D12E23 -110.91 2.42 -8.53 -0.59 0
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434425 135174911 1 FNO2C18H26 ABC2D18E26 -131.55 5.85 -9.17 0.07 0
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434426 135174912 1 NSO2C17H25 ABC2D17E25 -73.24 2.48 -8.87 -0.02 0
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434427 135174913 1 SN2O3C12H18 AB2C3D12E18 -80.94 1.18 -8.91 -0.56 0
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434428 135174914 1 FNSO4C17H26 ABCD4E17F26 -205.61 4.86 -8.21 -0.09 0
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434429 135174915 1 ClS2N10O18C73H99 AB2C10D18E73F99 -712.85 8.91 -8.78 -0.99 0
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434430 135174916 1 S2F3N8O14C60H73 A2B3C8D14E60F73 -596.45 8.91 -8.85 -0.91 0
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434431 135174917 1 ON5C29H61 AB5C29D61 -118.92 1.84 -8.0 2.28 0
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434434 135174920 1 P2N9O11C21H27 A2B9C11D21E27 -486.44 7.14 -8.97 -0.65 0
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434435 135174921 1 P2N9O12C21H27 A2B9C12D21E27 -510.98 8.22 -9.22 -1.06 0
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434436 135174922 1 P2O11N13C20H25 A2B11C13D20E25 -392.34 16.15 -8.85 -1.0 0
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434438 135174924 1 FPN4O6C11H14 ABC4D6E11F14 -319.31 3.89 -8.69 -0.36 0
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434439 135174925 1 P2N8O11C21H26 A2B8C11D21E26 -481.69 13.42 -9.03 -0.61 0
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434440 135174926 2 PN5O6C10H13 AB5C6D10E13 -498.98 9.87 -9.26 -1.05 0
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434442 135174928 1 N2S2C11H12 A2B2C11D12 69.61 2.18 -8.65 -1.17 0
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434443 135174929 1 O2N6C23H38 A2B6C23D38 17.77 3.33 -8.44 0.31 1
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434444 135174930 1 P2N9O12C21H26 A2B9C12D21E26 -493.0 10.73 0.0 0.0 0
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434445 135174931 1 PN5O5C10H14 AB5C5D10E14 -206.03 3.91 -9.24 -0.86 0
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434446 135174932 1 SP2N10O10C20H26 AB2C10D10E20F26 -424.97 2.22 -8.56 -1.28 0
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434447 135174933 1 P2N8O11C21H26 A2B8C11D21E26 -494.49 6.17 -9.07 -0.67 0
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434448 135174934 1 FPO9N10C20H24 ABC9D10E20F24 -369.64 6.82 -9.35 -0.8 0
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434449 135174945 1 ON2C17H36 AB2C17D36 -95.11 1.3 -8.04 2.23 0
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434451 135174948 1 F2P2S2O9N10C20H24 A2B2C2D9E10F20G24 -503.26 13.7 -8.98 -0.92 0
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434452 135174950 1 P2S2F3O9N10C20H23 A2B2C3D9E10F20G23 -541.91 12.47 -9.1 -1.14 0
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434453 135174969 1 PN2O5C6H13 AB2C5D6E13 -271.37 5.22 -9.41 0.54 0
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434454 135174970 1 P2N8O12C21H26 A2B8C12D21E26 -541.98 7.66 -8.9 -0.76 1
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434455 135174984 1 FP2S2O9N10C20H24 AB2C2D9E10F20G24 -363.86 8.34 0.0 0.0 0
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434456 135174985 1 PSO5N6C9H15 ABC5D6E9F15 -195.12 10.46 -8.48 -0.54 0
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434459 135174996 1 P2S2N9O9C22H29 A2B2C9D9E22F29 -399.43 18.62 -8.33 -0.71 0
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434460 135175000 1 N2O3C18H28 A2B3C18D28 -121.35 2.85 -8.67 0.25 0
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434461 135175001 1 N2C13H24 A2B13C24 5.33 1.42 -8.3 1.26 0
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434462 135175002 1 FNO3S3C14H18 ABC3D3E14F18 -121.24 3.39 -8.61 -0.74 0
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434463 135175003 1 NOS2C14H21 ABC2D14E21 -12.29 5.78 -8.4 -0.72 0
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434464 135175005 1 FNOC15H22 ABCD15E22 -91.52 2.71 -9.06 0.2 0
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434465 135175008 1 NSO7C9H11 ABC7D9E11 -233.09 1.08 -10.0 -2.23 0
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434466 135175009 1 NO2C9H13 AB2C9D13 -52.92 3.41 -9.87 -0.46 0
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434467 135175010 1 FNO2C12H16 ABC2D12E16 -102.99 5.27 -8.3 0.1 0