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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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46350 10524001 1 ClSO5C18H19 ABC5D18E19 -180.93 7.29 -8.43 -0.82 0
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46351 10524002 1 ClOSN2H19C21 ABCD2E19F21 24.42 6.1 -8.91 -1.03 0
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46352 10524009 1 BrSiO6C13H23 ABC6D13E23 -326.45 5.47 -9.15 -1.56 0
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46353 10524015 1 NS2O7C11H15 AB2C7D11E15 -241.84 7.4 -9.8 -1.62 0
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46354 10524021 1 F2N3O4C18H23 A2B3C4D18E23 -226.79 3.9 -10.1 -0.6 0
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46355 10524023 1 NS2O9C12H17 AB2C9D12E17 -355.51 2.43 -9.87 -1.34 0
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46356 10524029 1 NO5C22H25 AB5C22D25 -158.36 5.19 -9.01 -0.01 0
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46357 10524040 1 NPO3C21H38 ABC3D21E38 -213.45 1.23 -8.65 0.36 0
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46358 10524049 1 FSN2C11H11 ABC2D11E11 6.93 1.53 -9.24 -1.18 0
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46359 10524050 2 BrOC7H12 ABC7D12 -137.37 3.41 -10.35 -0.98 0
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46361 10524068 2 O3C11H12 A3B11C12 -210.27 0.75 -9.55 -0.15 0
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46362 10524071 1 N2O5C21H24 A2B5C21D24 -111.01 4.42 -8.78 -1.69 0
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46363 10524081 1 SN2O2H16C23 AB2C2D16E23 38.72 5.52 -8.79 -1.0 0
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46364 10524084 1 O7C20H32 A7B20C32 -327.3 2.93 -9.7 1.2 0
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46365 10524090 1 N2O2H24C25 A2B2C24D25 5.49 3.98 -9.19 -0.6 0
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46366 10524094 1 SN4O4C17H28 AB4C4D17E28 -103.09 7.46 -9.64 -0.44 0
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46367 10524100 1 N2O5C20H36 A2B5C20D36 -292.0 2.48 -9.12 0.37 0
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46368 10524106 1 SiO3N4C18H36 AB3C4D18E36 -174.76 3.25 -9.0 0.03 0
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46369 10524107 1 N2O3C22H44 A2B3C22D44 -222.33 7.36 -10.02 0.46 0
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46370 10524112 1 Si2O3C20H40 A2B3C20D40 -254.44 1.19 -8.8 0.63 0
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46371 10524113 1 OSiC24H52 ABC24D52 -205.16 1.64 -9.03 1.39 0
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46372 10524115 1 ClO6C19H25 AB6C19D25 -280.75 3.04 -9.14 -0.22 0
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46373 10524125 1 PF2O4N5C14H14 AB2C4D5E14F14 -242.1 9.89 -9.24 -0.85 0
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46374 10524127 1 NO7H19C20 AB7C19D20 -232.46 1.14 -8.94 -1.23 0
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46375 10524134 1 SN3O6C16H23 AB3C6D16E23 -168.85 5.79 -9.37 -0.7 0
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46376 10524135 1 NO5C22H27 AB5C22D27 -158.91 3.25 -8.57 -0.82 0
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46377 10524136 1 N3O6C18H31 A3B6C18D31 -309.87 4.03 -9.92 -0.02 0
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46378 10524146 1 NO4C23H31 AB4C23D31 -183.21 1.17 -9.37 0.23 0
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46379 10524151 1 NS2O3H19C20 AB2C3D19E20 -51.09 1.95 -8.96 -0.62 0
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46380 10524152 1 O2N5C21H31 A2B5C21D31 -73.22 4.13 -7.93 0.07 0
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46381 10524153 1 NSO3C22H27 ABC3D22E27 -111.8 1.5 -9.45 -0.9 0
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46382 10524155 1 NSiO4C21H27 ABC4D21E27 -169.74 6.14 -9.22 -0.81 0
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46383 10524160 1 NSO2C23H31 ABC2D23E31 -63.55 3.75 -8.06 -0.06 0
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46384 10524165 1 N2O2Cl3H15C17 A2B2C3D15E17 -26.9 5.97 -9.26 -1.01 0
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46385 10524173 1 BrNO3F6C10H10 ABC3D6E10F10 -430.67 5.93 -10.47 -1.32 0
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46386 10524181 2 N2O3C9H9 A2B3C9D9 -53.65 1.93 -8.85 -2.86 0
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46387 10524185 1 O7C21H22 A7B21C22 -236.95 6.24 -9.55 -0.95 0
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46388 10524186 1 O5H18C24 A5B18C24 -85.32 1.93 -8.49 -0.33 0
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46389 10524198 1 O4H22C25 A4B22C25 -103.29 3.58 -8.95 -0.77 0
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46390 10524207 1 O2N4H22C23 A2B4C22D23 68.62 4.12 -9.33 -0.08 0
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46391 10524210 1 SN2O6C17H26 AB2C6D17E26 -267.16 3.42 -9.18 -0.34 0
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46392 10524216 1 O5C23H30 A5B23C30 -239.72 3.67 -9.74 -0.03 0
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46393 10524223 1 SO6C19H30 AB6C19D30 -263.06 2.91 -9.43 0.08 0
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46394 10524225 1 SN2O3C21H26 AB2C3D21E26 -76.91 4.53 -8.59 -0.66 0
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46395 10524228 1 N2O5C20H38 A2B5C20D38 -288.41 1.85 -9.25 0.36 0
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46396 10524240 1 ClN2O4H19C20 AB2C4D19E20 -122.04 3.24 -9.03 -0.92 0
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46397 10524241 1 O3Cl6H6C10 A3B6C6D10 -88.78 2.01 -9.94 -1.63 0
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46398 10524245 1 BrFN2O3C16H20 ABC2D3E16F20 -179.37 4.04 -9.7 -0.62 0
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46399 10524247 1 Cl2O5C18H20 A2B5C18D20 -175.77 4.23 -8.63 -0.47 0
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46402 10524267 1 N3O3H21C23 A3B3C21D23 -31.35 5.35 -8.23 -1.66 0
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46403 10524274 1 NO3C25H25 AB3C25D25 -59.3 4.88 -8.9 -1.02 0
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46404 10524277 1 N3O4C21H29 A3B4C21D29 -169.32 1.75 -8.53 -0.09 0
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46405 10524278 1 O2N3C24H25 A2B3C24D25 141.55 3.38 -9.14 -0.66 0
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46407 10524282 1 NSO4C21H25 ABC4D21E25 -140.52 1.44 -8.68 -0.17 0
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46408 10524285 1 NO2C26H29 AB2C26D29 -32.83 2.68 -8.64 -0.43 0
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46409 10524290 1 N2Cl3O4H9C15 A2B3C4D9E15 -99.11 4.64 -9.32 -2.13 0
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46410 10524292 1 ClNOSF4H10C17 ABCDE4F10G17 -163.76 0.28 -9.45 -1.39 0
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46411 10524294 1 ClNSO2C21H22 ABCD2E21F22 -45.67 1.99 -9.16 -0.88 0
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46412 10524299 1 NOSnC17H35 ABCD17E35 -87.72 4.14 -8.45 0.73 0
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46413 10524302 1 FOCl2N3H12C19 ABC2D3E12F19 12.95 3.23 -8.81 -1.27 0
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46414 10524303 1 FCl2N5H12C18 AB2C5D12E18 63.04 2.04 -8.93 -1.09 0
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46415 10524306 1 BrO2N3C18H18 AB2C3D18E18 -18.94 3.1 -8.82 -0.77 0
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46416 10524320 1 N4O5C19H24 A4B5C19D24 -192.59 3.97 -8.76 -1.25 0
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46417 10524328 1 SN2O5C19H20 AB2C5D19E20 -124.03 7.91 -9.33 -1.66 1
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46418 10524347 1 N2C14H21 A2B14C21 48.66 1.75 0.0 0.0 0
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46419 10524348 1 SN2O3C21H28 AB2C3D21E28 -86.07 4.66 -8.76 -0.2 0
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46420 10524349 1 N4C25H32 A4B25C32 61.63 2.47 -8.1 0.03 0
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46421 10524350 1 OSN4C21H32 ABC4D21E32 40.18 6.99 -9.22 -1.29 0
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46422 10524351 1 SiN2O3C21H32 AB2C3D21E32 -146.73 7.74 -8.86 -0.48 0
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46423 10524356 1 SiO2C24H40 AB2C24D40 -157.01 0.74 -8.78 0.05 1
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46424 10524368 1 FSO2N4H12C16 ABC2D4E12F16 21.3 6.16 0.0 0.0 0
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46425 10524369 1 F3N3O4C17H22 A3B3C4D17E22 -300.81 4.16 -9.52 -0.8 0
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46426 10524371 1 FN3O5C19H20 AB3C5D19E20 -228.15 7.92 -9.91 -1.57 0
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46427 10524381 1 NSO6C19H19 ABC6D19E19 -203.36 7.82 -9.44 -1.5 0
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46428 10524382 1 NO4H23C24 AB4C23D24 -101.47 4.24 -9.36 -0.38 0