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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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343259 127266432 1 ClN2S2O4H25C27 AB2C2D4E25F27 -100.9 7.94 -8.7 -1.44 0
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343260 127266433 1 SCl2O2N4C20H28 AB2C2D4E20F28 -84.4 11.95 -8.16 -1.56 0
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343261 127266434 1 BrClNO6H19C23 ABCD6E19F23 -82.57 4.96 -9.08 -1.19 0
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343262 127266435 1 ClNO6H24C25 ABC6D24E25 -20.02 19.38 -9.59 -2.31 0
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343263 127266436 1 ClFSN3O3H15C19 ABCD3E3F15G19 -50.22 5.38 -8.64 -1.76 0
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343264 127266437 1 ClFSN3O3H15C19 ABCD3E3F15G19 -47.54 3.03 -8.6 -1.82 0
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343265 127266438 1 NPSO3H26C27 ABCD3E26F27 -86.05 11.47 -8.71 -0.98 0
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343266 127266439 1 N3O4H19C20 A3B4C19D20 -36.59 5.85 -8.91 -0.74 0
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343267 127266440 1 FON2H15C20 ABC2D15E20 5.58 4.33 -8.95 -0.87 0
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343268 127266441 1 ON3C22H25 AB3C22D25 -1.81 4.28 -8.54 -0.19 0
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343269 127266442 1 FN2O4C17H25 AB2C4D17E25 -240.61 2.41 -8.77 -0.19 0
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343270 127266443 1 ON4C20H24 AB4C20D24 6.58 5.33 -8.68 -0.04 0
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343271 127266444 1 ClOSN5C21H22 ABCD5E21F22 73.41 13.68 -8.54 -1.2 0
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343272 127266445 3 NOC5H5 ABC5D5 -27.53 5.58 -8.53 -1.17 0
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343273 127266446 1 SO2N3C19H23 AB2C3D19E23 -10.3 4.65 -8.9 -1.11 0
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343274 127266447 1 ClSO3N4C16H23 ABC3D4E16F23 -54.73 10.22 -8.51 -1.32 0
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343275 127266448 1 OSN4C15H20 ABC4D15E20 43.35 4.06 -8.65 -0.78 0
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343276 127266449 1 ON5H19C20 AB5C19D20 83.93 3.94 -8.79 -1.02 0
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343277 127266450 1 BrClN2O5H12C18 ABC2D5E12F18 -114.85 1.92 -8.9 -2.08 0
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343278 127266451 1 NCl2O3H15C19 AB2C3D15E19 -47.38 5.83 -7.99 -1.48 0
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343279 127266452 1 BrOSN2C21H23 ABCD2E21F23 34.34 6.35 -8.31 -1.03 0
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343280 127266453 1 SN3O3H17C18 AB3C3D17E18 43.77 10.65 -8.64 -1.29 0
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343281 127266454 1 ClON2S2H17C20 ABC2D2E17F20 58.18 4.62 -8.34 -1.12 0
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343282 127266455 1 ClSO2N4H13C17 ABC2D4E13F17 51.24 8.69 -8.58 -1.52 0
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343283 127266456 1 SN3O4C13H13 AB3C4D13E13 -74.57 6.01 -8.67 -1.45 0
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343284 127266457 1 O4N5C14H15 A4B5C14D15 13.85 11.63 -8.88 -1.8 0
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343285 127266458 1 ClSN6H15C16 ABC6D15E16 132.18 7.42 -8.9 -1.45 0
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343286 127266459 1 SN4O7H20C21 AB4C7D20E21 -79.02 3.74 -8.53 -1.86 0
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343287 127266460 1 SN5O6C24H27 AB5C6D24E27 -71.87 11.99 -8.29 -1.49 0
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343288 127266461 1 BrON3H16C22 ABC3D16E22 103.7 4.46 -9.15 -1.18 0
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343289 127266462 1 SN4O7H20C21 AB4C7D20E21 -77.71 4.08 -8.86 -1.8 0
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343290 127266463 1 ClSN4O6H17C20 ABC4D6E17F20 -72.23 3.83 -9.32 -2.0 0
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343291 127266464 1 ClSN3O5H16C20 ABC3D5E16F20 -89.34 0.4 -8.58 -1.43 0
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343292 127266465 1 SN4O8H18C21 AB4C8D18E21 -132.07 11.94 -9.02 -1.88 0
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343293 127266466 1 N3O4C23H27 A3B4C23D27 -68.87 8.62 -8.73 -0.88 0
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343294 127266467 1 ClN3O7C20H22 AB3C7D20E22 -133.02 13.72 -9.01 -1.89 0
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343295 127266468 1 ON3H17C19 AB3C17D19 87.38 6.55 -8.81 -1.0 0
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343296 127266469 2 NO2H10C11 AB2C10D11 -41.0 6.15 -8.6 -1.28 0
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343297 127266470 1 N2O4H18C21 A2B4C18D21 -43.2 5.24 -8.37 -1.0 0
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343298 127266471 1 SN4O4H14C15 AB4C4D14E15 28.52 7.13 -9.28 -2.21 0
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343299 127266472 1 SN5C15H17 AB5C15D17 118.54 3.73 -8.89 -1.2 0
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343300 127266473 1 SO2N4H14C19 AB2C4D14E19 64.33 8.88 -9.03 -1.36 0
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343301 127266474 1 N3O3C19H21 A3B3C19D21 -46.82 5.87 -8.57 -1.1 0
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343302 127266475 1 O2N4C15H16 A2B4C15D16 0.23 7.35 -8.86 -1.15 0
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343303 127266476 1 ClSN4O4C18H21 ABC4D4E18F21 -89.17 5.92 -8.35 -1.36 0
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343304 127266477 1 ON4C23H26 AB4C23D26 51.53 8.69 -8.62 -0.86 0
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343305 127266478 1 O2N4C19H22 A2B4C19D22 -18.41 8.38 -8.75 -0.98 0
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343306 127266479 1 N4O4H18C19 A4B4C18D19 -32.41 8.3 -8.45 -1.18 0
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343307 127266480 1 ClSO2N6H17C21 ABC2D6E17F21 68.22 5.09 -8.67 -1.45 0
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343308 127266481 1 F3N6O6H11C17 A3B6C6D11E17 -111.41 4.94 -9.11 -2.34 0
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343309 127266482 1 ClON3S3H42C48 ABC3D3E42F48 139.3 12.7 -7.93 -1.15 1
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343310 127266483 1 ON3S3H42C48 AB3C3D42E48 144.62 6.19 0.0 0.0 0
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343311 127266484 1 PSN2O5H33C36 ABC2D5E33F36 -97.52 7.4 -8.49 -1.41 0
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343312 127266485 1 OPS2N5H34C35 ABC2D5E34F35 61.06 9.13 -8.47 -0.88 0
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343313 127266486 2 ON2C16H18 AB2C16D18 39.41 5.05 -7.87 -1.04 0
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343314 127266487 1 ON4C17H20 AB4C17D20 17.96 2.29 -8.7 -0.2 0
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343315 127266488 4 NC5H7 AB5C7 51.67 2.52 -8.07 0.17 0
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343316 127266489 1 O2N4C19H24 A2B4C19D24 29.88 8.23 -8.5 -1.16 0
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343317 127266490 1 BrOSN2H9C13 ABCD2E9F13 63.58 5.33 -8.71 -1.81 0
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343318 127266491 1 OSN5C16H17 ABC5D16E17 37.78 1.22 -8.92 -0.89 0
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343319 127266492 1 ON4C13H22 AB4C13D22 -23.63 7.27 -9.65 0.33 0
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343320 127266493 1 SO2N3C12H13 AB2C3D12E13 -50.51 4.1 -8.56 -0.42 0
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343321 127266494 1 SF3O4C14H17 AB3C4D14E17 -317.97 7.37 -9.64 -0.42 0
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343322 127266495 1 ClFON2H12C14 ABCD2E12F14 -32.37 2.24 -9.39 -0.4 0
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343323 127266496 1 N2O4C17H18 A2B4C17D18 -82.05 4.73 -9.89 -1.18 0
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343324 127266497 1 N3O3C16H17 A3B3C16D17 -51.83 8.57 -9.54 -1.08 0
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343325 127266498 1 NSO3H15C16 ABC3D15E16 -64.93 1.27 -9.08 -0.85 0
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343326 127266499 1 N3O3H13C17 A3B3C13D17 -27.22 9.03 -9.24 -1.4 0
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343327 127266500 1 NSO3C13H15 ABC3D13E15 -90.26 3.1 -9.02 -0.72 0
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343328 127266501 1 FNSO3H14C16 ABCD3E14F16 -112.97 2.0 -9.14 -0.91 0
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343329 127266502 1 FNO3C15H18 ABC3D15E18 -164.37 1.84 -9.81 -0.26 0
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343330 127266503 1 ClS4N5O5C25H28 AB4C5D5E25F28 -139.72 4.74 -8.5 -1.57 0
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343331 127266504 1 SN2O2C16H18 AB2C2D16E18 -42.33 1.62 -8.99 -1.44 0
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343332 127266505 1 ClSN3O4C24H28 ABC3D4E24F28 -96.66 5.72 -8.43 -1.46 0
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343333 127266506 1 O3N4C17H22 A3B4C17D22 -112.67 2.4 -8.77 -0.32 0