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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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188961 77794639 2 FO2C7H10 AB2C7D10 -280.71 4.45 -9.79 -0.31 0
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188962 77794640 1 BrClN5O5C21H21 ABC5D5E21F21 -137.41 3.46 -9.12 -0.98 0
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188963 77794813 1 O3N4C27H34 A3B4C27D34 -81.62 1.99 -8.27 -0.36 0
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188964 77795085 1 F3O3C22H33 A3B3C22D33 -352.99 5.1 -10.02 0.63 0
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188965 77795200 1 O5C26H44 A5B26C44 -266.23 9.87 -9.82 -0.09 1
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188966 77795201 1 PN2O8C33H50 AB2C8D33E50 -384.53 5.05 0.0 0.0 0
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188967 77795577 1 ClO2N3C15H20 AB2C3D15E20 -7.38 2.77 -9.32 -0.66 0
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188968 77795748 1 ON4H6C7 AB4C6D7 63.12 5.47 -9.97 -2.29 0
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188969 77795749 1 N3O5C10H15 A3B5C10D15 -186.15 4.57 -10.38 -1.01 0
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188970 77795750 1 N3O8C26H29 A3B8C26D29 -283.3 1.86 -9.7 -0.33 0
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188971 77795861 1 N2O4C13H22 A2B4C13D22 -208.86 2.24 -9.98 0.72 0
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188972 77795862 1 F3N4O8C24H29 A3B4C8D24E29 -438.45 13.29 -9.46 -0.73 0
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188973 77796031 1 N3O4C29H35 A3B4C29D35 -98.52 6.07 -8.43 0.13 0
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188974 77796032 1 N2O5C32H36 A2B5C32D36 -122.15 4.47 -8.57 -0.42 0
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188975 77796033 1 N2O3C30H34 A2B3C30D34 -47.17 6.24 -8.47 -0.25 0
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188976 77796044 1 ClSSiN3O4C20H30 ABCD3E4F20G30 -178.48 6.28 -8.72 -0.85 0
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188977 77796575 3 OC10H18 AB10C18 -242.62 2.93 -9.96 2.13 0
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188978 77796582 1 N2O5H16C18 A2B5C16D18 -97.95 6.77 -9.78 -1.64 0
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188979 77796781 1 N2F3O5C38H39 A2B3C5D38E39 -281.3 2.62 -8.27 -0.87 0
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188980 77796782 1 O11C30H58 A11B30C58 -575.92 3.28 -10.1 -0.09 0
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188981 77796783 1 F3O7N9C25H36 A3B7C9D25E36 -408.78 8.47 -9.48 -0.67 0
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188982 77796784 1 O5N9C23H35 A5B9C23D35 -168.46 6.7 -9.17 -0.32 0
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188983 77796785 1 SN2O5C27H32 AB2C5D27E32 -155.27 3.87 -8.66 -0.02 0
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188984 77796943 1 N2O4C31H34 A2B4C31D34 -40.69 6.27 -8.6 -0.48 0
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188985 77796944 1 N2O5C34H40 A2B5C34D40 -132.87 4.61 -8.4 -0.28 0
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188986 77796945 1 N2O5C34H40 A2B5C34D40 -131.09 6.24 -8.37 -0.38 0
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188987 77797396 1 Cl2N2O5C31H36 A2B2C5D31E36 -197.37 6.54 -8.57 -0.48 0
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188988 77797479 1 BrSN2O6C32H35 ABC2D6E32F35 -44.0 7.53 -8.65 -1.37 1
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188989 77797729 1 N2F3O5C35H42 A2B3C5D35E42 -281.95 16.27 0.0 0.0 0
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188990 77797730 1 N2F3O5C35H39 A2B3C5D35E39 -305.94 4.31 -8.72 -0.81 0
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188991 77798591 2 FNOC16H21 ABCD16E21 -169.18 6.45 -8.96 -0.05 0
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188992 77798592 1 O4N5C20H21 A4B5C20D21 -75.14 9.28 -8.7 -0.92 0
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188993 77798851 1 ON5C17H23 AB5C17D23 27.59 6.04 -9.19 -0.68 0
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188994 77799138 1 ClF2O2N5H28C30 AB2C2D5E28F30 -57.48 8.16 -8.88 -0.85 1
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188995 77799705 1 N8O10C46H55 A8B10C46D55 -240.51 2.53 0.0 0.0 0
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188996 77800171 1 O3N7C21H25 A3B7C21D25 -32.79 7.66 -9.38 -1.25 0
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188997 77800398 1 SO3N6C25H30 AB3C6D25E30 -1.93 7.74 -8.37 -1.04 0
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188998 77801099 1 O3N4C19H22 A3B4C19D22 -47.46 3.22 -9.19 -0.48 0
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188999 77801533 1 FN2O2Cl3C22H24 AB2C2D3E22F24 -129.89 6.73 -9.54 -0.73 1
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189000 77801890 1 O2N5C24H30 A2B5C24D30 -12.68 2.91 0.0 0.0 0
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189001 77801891 1 ON5C24H35 AB5C24D35 -23.83 2.82 -8.08 0.18 0
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189002 77801992 1 ClO2N3C23H30 AB2C3D23E30 -63.38 3.76 -8.74 -0.49 0
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189003 77801993 1 S2N4O11C14H22 A2B4C11D14E22 -413.5 9.14 -8.96 -1.39 0
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189004 77802302 1 O3C29H44 A3B29C44 -166.88 8.3 -9.07 -0.87 0
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189005 77802497 1 SF2N3O3C15H19 AB2C3D3E15F19 -187.2 2.17 -8.88 -0.71 0
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189006 77802498 1 N2O4C27H30 A2B4C27D30 -95.23 4.2 -8.75 -0.66 0
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189007 77802499 1 O4N5C23H23 A4B5C23D23 -79.93 12.06 -9.17 -1.48 0
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189008 77802513 1 N2O8C23H34 A2B8C23D34 -365.97 12.98 -10.11 -0.38 0
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189009 77802608 2 NOH11C13 ABC11D13 36.49 2.69 -9.37 -0.43 0
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189010 77802609 1 NF2O5H17C18 AB2C5D17E18 -250.66 2.01 -9.76 -0.66 0