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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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224381 85342305 1 SN2O4C20H26 AB2C4D20E26 -127.12 5.59 -8.78 -0.14 0
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224383 85342329 1 NO2H23C27 AB2C23D27 40.28 5.02 -9.41 -1.17 0
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224384 85342337 1 FN2O3C23H23 AB2C3D23E23 -102.62 5.97 -8.43 -0.3 0
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224385 85342339 1 O9C18H34 A9B18C34 -414.44 4.8 -9.71 0.38 0
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224386 85342351 1 S2N3O4C17H21 A2B3C4D17E21 -107.3 5.94 -8.84 -1.15 0
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224387 85342361 1 SO6C20H28 AB6C20D28 -261.33 5.38 -10.13 -0.65 0
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224388 85342362 1 SN2O3C22H28 AB2C3D22E28 -115.65 4.06 -9.06 -0.68 0
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224389 85342406 1 Cl2O3H18C22 A2B3C18D22 -78.29 2.94 -9.45 -0.61 0
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224390 85342423 1 Si2O5C19H38 A2B5C19D38 -333.61 1.83 -8.76 0.38 0
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224391 85342427 1 NO6C22H29 AB6C22D29 -264.54 5.18 -9.64 -0.54 0
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224392 85342433 1 O6C23H32 A6B23C32 -200.26 5.18 -9.4 0.08 0
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224394 85342468 1 SN3O3C21H33 AB3C3D21E33 -46.04 3.73 -8.69 -0.33 0
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224397 85342472 1 BrOS2N3H14C16 ABC2D3E14F16 48.32 2.27 -8.68 -1.35 0
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224398 85342473 1 N2O2F3H15C23 A2B2C3D15E23 -119.79 4.9 -9.0 -1.5 0
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224399 85342474 1 PO7C20H25 AB7C20D25 -306.02 5.15 -9.77 -0.09 0
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224400 85342490 1 BrO5C19H21 AB5C19D21 -145.81 1.91 -8.42 -0.55 0
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224401 85342491 1 BrN2O6C15H25 AB2C6D15E25 -286.15 6.22 -9.94 -0.52 0
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224402 85342500 1 NOSiC26H39 ABCD26E39 -66.67 1.49 -8.86 0.28 0
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224403 85342501 1 ClSO2N3H16C21 ABC2D3E16F21 52.88 1.76 -9.16 -1.21 0
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224404 85342511 1 NSiO6C20H33 ABC6D20E33 -317.15 1.41 -8.99 -0.16 0
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224405 85342516 2 O3C12H14 A3B12C14 -194.94 6.73 -8.44 -0.28 0
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224406 85342523 1 SiO6C21H36 AB6C21D36 -317.69 4.67 -8.93 0.12 0
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224407 85342563 1 N3O3C25H27 A3B3C25D27 -73.55 5.51 -9.09 -0.2 0
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224408 85342569 2 NOH11C14 ABC11D14 43.78 6.39 -8.72 -0.39 0
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224409 85342607 1 O3C28H38 A3B28C38 -122.53 1.8 -9.2 -0.02 0
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224410 85342621 1 N2O3C17H23 A2B3C17D23 -61.65 7.75 0.0 0.0 0
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224411 85342638 1 IO5C16H27 AB5C16D27 -263.77 1.78 -9.75 -1.02 0
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224412 85342641 1 SiN2O4C23H30 AB2C4D23E30 -179.32 3.74 -8.51 -0.12 0
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224414 85342716 2 O6C9H13 A6B9C13 -502.96 3.54 -10.46 0.36 0
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224415 85342724 1 OSi4C22H42 AB4C22D42 -143.01 2.44 -7.23 0.24 0
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224416 85342725 1 SeO3H20C24 AB3C20D24 -28.25 3.89 -8.84 -0.81 0
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224417 85342741 1 PO10C18H31 AB10C18D31 -533.8 4.69 -9.98 0.29 0
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224418 85342742 1 O7C25H26 A7B25C26 -262.35 5.68 -8.8 -0.4 0
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224420 85342748 1 FN2O3C26H31 AB2C3D26E31 -95.76 7.34 -8.75 -0.93 0
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224421 85342753 1 N5O9C17H21 A5B9C17D21 -342.6 3.15 -9.89 -1.35 0
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224422 85342754 2 ClNSH6C11 ABCD6E11 132.09 3.23 -9.02 -1.5 0
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224423 85342756 1 NSO5C24H25 ABC5D24E25 -162.83 5.98 -8.62 -1.37 0
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224424 85342760 1 NSiO5C23H41 ABC5D23E41 -252.1 2.89 -8.87 0.15 1
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224425 85342763 1 N3C23H26 A3B23C26 86.55 2.84 0.0 0.0 0
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224426 85342768 1 O3C29H44 A3B29C44 -181.71 4.71 -9.15 0.56 0
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224427 85342771 1 ClN2O8C19H21 AB2C8D19E21 -291.82 3.14 -9.96 -0.82 0
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224428 85342772 1 BrO5C21H29 AB5C21D29 -221.44 4.81 -9.47 -0.34 0
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224429 85342786 1 ClFO2N4C23H24 ABC2D4E23F24 -44.29 8.45 -6.9 -0.15 0
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224430 85342808 1 IO4C19H27 AB4C19D27 -148.14 3.83 -8.63 -0.6 0
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224431 85342814 1 O5C27H42 A5B27C42 -255.53 1.97 -8.7 1.05 0
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224432 85342815 1 SiO4C26H42 AB4C26D42 -239.74 0.9 -8.78 0.3 0
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224433 85342840 1 SN2O5H22C24 AB2C5D22E24 -110.01 2.79 -9.07 -1.14 0
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224434 85342842 3 O2C9H10 A2B9C10 -146.5 3.49 -8.35 -0.07 0
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224435 85342843 1 N2O7C23H34 A2B7C23D34 -278.44 5.57 -9.16 -0.65 0
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224436 85342850 1 OSnC23H40 ABC23D40 -59.46 1.46 -8.79 0.32 0
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224437 85342870 1 NSiO3C27H39 ABC3D27E39 -152.65 1.7 -8.96 -0.1 0
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224438 85342885 1 O4C19H25 A4B19C25 -132.81 0.97 0.0 0.0 0
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224440 85342891 1 SiO2C30H36 AB2C30D36 -73.93 2.03 -8.49 0.1 0
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224441 85342896 1 N3C31H43 A3B31C43 31.64 1.39 -8.19 0.27 0
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224442 85342900 2 NO2C14H15 AB2C14D15 -29.83 11.15 -8.84 -1.13 0
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224443 85342909 1 NO6H25C27 AB6C25D27 -182.64 8.34 -9.13 -0.89 0
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224444 85342910 1 SN3O6C22H25 AB3C6D22E25 -200.41 3.04 -9.62 -0.91 0
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224445 85342911 1 NSO6C24H29 ABC6D24E29 -177.72 4.21 -9.12 -0.67 0
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224446 85342913 1 NO6C26H37 AB6C26D37 -142.13 5.26 -8.87 -0.59 0
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224447 85342914 1 NO4C29H33 AB4C29D33 -97.21 4.43 -8.36 -1.64 0
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224448 85342954 1 CrNO3C16H19 ABC3D16E19 77.23 3.31 -6.28 -0.17 0
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224449 85343052 1 SO7C25H34 AB7C25D34 -276.47 5.7 -9.39 -0.56 0
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224450 85343072 1 SiO5C28H38 AB5C28D38 -247.5 3.14 -8.95 0.11 0
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224453 85343155 1 SiN2O6C26H34 AB2C6D26E34 -264.02 1.57 -9.32 -0.29 0
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224454 85343169 2 O4C14H17 A4B14C17 -243.91 4.37 -9.0 0.01 0
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224455 85343181 2 O5C13H14 A5B13C14 -299.58 5.68 -9.36 -0.13 0
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224457 85343253 1 SO2C34H40 AB2C34D40 7.37 5.84 -8.85 -0.52 0
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224458 85343300 1 N4O5C29H36 A4B5C29D36 -125.91 5.76 -8.72 -1.03 0
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224459 85343347 1 NO2C37H37 AB2C37D37 40.29 4.23 -8.72 -0.06 0
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224460 85343348 1 O3Br4C12H16 A3B4C12D16 -101.27 3.33 -9.72 -0.56 0
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224461 85343407 3 O3C10H12 A3B10C12 -299.89 3.7 -9.43 0.23 0
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224462 85343433 1 BrO8C25H37 AB8C25D37 -328.0 2.12 -9.53 -0.01 0
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224464 85343487 1 NSiO6C31H45 ABC6D31E45 -308.25 3.54 -9.07 -0.01 0
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224465 85343496 1 ClNOPSC33H33 ABCDEF33G33 67.32 19.24 -7.13 -1.24 0
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224466 85343501 1 NO9C30H41 AB9C30D41 -321.83 6.46 -8.75 -0.05 0