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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193389 78387204 1 OCl2N3H15C16 AB2C3D15E16 0.95 8.56 -9.37 -0.59 0
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193390 78387574 1 O2N3C13H21 A2B3C13D21 -115.66 5.99 -9.78 0.04 0
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193391 78387826 1 NO4C22H23 AB4C22D23 -23.04 7.19 -8.93 -2.08 0
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193392 78387827 1 N3O5H15C16 A3B5C15D16 -83.94 7.75 -9.37 -2.12 0
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193393 78387828 1 ClNOC10H12 ABCD10E12 -28.66 5.64 -8.26 -0.8 0
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193394 78387829 1 N2C3O4H6 A2B3C4D6 -84.28 4.0 -11.65 -1.38 0
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193395 78387830 1 ClO2N3H8C10 AB2C3D8E10 33.58 1.27 -8.99 -1.54 0
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193396 78388885 1 N3O4C23H29 A3B4C23D29 -97.1 4.29 -8.17 -0.44 0
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193397 78389611 1 O3N5C17H21 A3B5C17D21 -102.77 6.8 -9.7 -0.6 0
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193398 78389612 1 OSN3H7C9 ABC3D7E9 93.5 3.64 -9.19 -3.0 0
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193399 78389981 1 N3O3C19H19 A3B3C19D19 -83.96 10.0 -8.94 -1.11 0
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193400 78390007 1 ClNOH14C18 ABCD14E18 27.09 2.38 -9.01 -1.31 0
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193401 78391029 1 O2F3N6H21C22 A2B3C6D21E22 -104.57 4.34 -9.15 -0.78 0
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193402 78391030 1 OCl2F3N4C18H21 AB2C3D4E18F21 -185.64 1.73 -9.26 -0.9 0
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193403 78391031 1 ClOF3N5C17H21 ABC3D5E17F21 -162.93 2.59 -9.28 -0.99 0
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193404 78391032 1 ClO2N5H8C10 AB2C5D8E10 -6.04 7.99 -9.66 -1.79 0
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193405 78391540 1 BrNO2H42C43 ABC2D42E43 66.5 0.9 -9.17 -0.38 0
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193406 78391541 1 BrN2O2C35H35 AB2C2D35E35 41.25 3.66 -9.2 -0.33 0
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193407 78391542 1 BrN2O3H39C42 AB2C3D39E42 35.5 5.55 -9.19 -0.86 0
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193408 78391543 1 SiO4C15H28 AB4C15D28 -220.54 1.93 -8.97 0.51 0
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193409 78391544 1 SiO5C27H34 AB5C27D34 -202.96 3.53 -9.0 0.02 0
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193410 78391545 1 O5C16H18 A5B16C18 -148.83 2.65 -10.1 -0.66 0
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193411 78391575 1 ION2C16H19 ABC2D16E19 37.88 3.21 -9.23 -0.8 0
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193412 78391576 1 TcO3N4C27H30 AB3C4D27E30 75.83 11.38 0.0 0.0 0
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193413 78391577 1 TcO3N4C30H36 AB3C4D30E36 98.51 4.12 0.0 0.0 0
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193414 78391578 1 O3N4C30H36 A3B4C30D36 -31.82 16.03 -7.93 -1.09 0
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193415 78391579 1 STcN2O3C9H16 ABC2D3E9F16 95.04 4.84 0.0 0.0 0
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193416 78391649 1 O17H28C35 A17B28C35 -616.7 10.75 -8.72 -1.46 0
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193417 78391695 1 NO3H13C15 AB3C13D15 -69.39 7.15 -8.88 -1.02 0
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193418 78391730 1 FON3H16C20 ABC3D16E20 23.39 8.12 -8.53 -0.94 0
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193419 78391859 1 ClS2N4O5H19C26 AB2C4D5E19F26 -32.75 4.07 -8.87 -1.43 0
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193420 78392199 2 O2S2N4C35H69 A2B2C4D35E69 -454.63 5.7 -8.84 -0.8 0
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193421 78392520 1 SN8O13C49H70 AB8C13D49E70 -584.59 11.61 -9.34 -0.67 0
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193422 78392521 1 SO13N14C65H96 AB13C14D65E96 -592.78 6.28 -8.81 -0.59 0
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193423 78392522 1 N10O17C50H70 A10B17C50D70 -763.22 7.7 -9.09 -0.21 0
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193424 78392523 1 N9O15C47H65 A9B15C47D65 -672.31 3.14 -9.17 -0.18 0
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193425 78393620 1 Cl2O3N4C15H18 A2B3C4D15E18 33.49 17.51 -6.97 -3.22 1
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193426 78393664 1 IO2N3C13H13 AB2C3D13E13 72.89 7.61 0.0 0.0 0
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193427 78393813 1 SN2O2H14C16 AB2C2D14E16 11.97 6.13 -8.91 -1.45 0
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193428 78394043 1 N9O15C34H59 A9B15C34D59 -743.17 6.63 -10.13 -0.28 0
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193429 78394426 1 ClN2O3H21C23 AB2C3D21E23 -26.28 8.42 -8.34 -0.56 1
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193430 78394680 1 ON3C27H28 AB3C27D28 98.38 0.7 0.0 0.0 0
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193431 78394690 1 NCl2O3C22H27 AB2C3D22E27 -128.02 8.0 -8.84 -0.46 -1
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193432 78394779 1 NSO4H18C19 ABC4D18E19 -59.45 1.02 0.0 0.0 -1
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193433 78394780 1 BrS2N3O4H9C17 AB2C3D4E9F17 78.38 5.28 0.0 0.0 1
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193434 78395051 1 SO2N4C20H23 AB2C4D20E23 -15.97 3.44 0.0 0.0 -1
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193435 78395084 1 N4O6H13C18 A4B6C13D18 -1.78 8.43 0.0 0.0 1
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193436 78395088 1 SO2N5C14H24 AB2C5D14E24 -46.51 17.8 0.0 0.0 1
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193437 78395089 1 OSN4C19H21 ABC4D19E21 27.79 6.13 0.0 0.0 1
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193438 78395090 1 SO2N5C17H22 AB2C5D17E22 -5.85 9.3 0.0 0.0 0