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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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202 2293 2 NO9C17H20 AB9C17D20 -724.07 6.4 -8.62 -0.42 0
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203 2294 1 N2O3C8H12 A2B3C8D12 -150.39 1.98 -11.01 -0.69 0
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205 2299 1 S2N3O4C23H31 A2B3C4D23E31 -115.37 3.02 -9.07 -0.85 0
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206 2309 1 NO4C16H21 AB4C16D21 -130.01 2.94 -9.01 -1.11 0
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207 2311 1 N2O5C24H28 A2B5C24D28 -183.08 4.98 -9.39 -0.58 0
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208 2312 1 NOC19H31 ABC19D31 -52.23 3.12 -8.7 0.62 0
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209 2316 1 N3O4C23H27 A3B4C23D27 -118.41 1.02 -9.33 -0.72 0
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210 2317 2 OSN2C16H27 ABC2D16E27 -69.06 3.39 -8.62 -0.93 0
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211 2318 1 NO2F3C19H20 AB2C3D19E20 -210.67 4.06 -9.28 -0.74 0
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212 2319 1 F3N3O4C13H16 A3B3C4D13E16 -161.87 1.99 -9.92 -2.03 0
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213 2321 2 NO4C16H29 AB4C16D29 -398.74 11.02 -9.51 0.2 0
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214 2322 1 N2O7C17H30 A2B7C17D30 -323.89 5.31 -9.91 0.48 0
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215 2323 1 N2O7C18H32 A2B7C18D32 -318.15 4.13 -9.53 0.44 0
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216 2326 1 NOC21H27 ABC21D27 -10.89 1.96 -8.48 0.27 0
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217 2330 1 NC22H40 AB22C40 -23.26 1.7 0.0 0.0 1
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218 2331 1 NOC7H7 ABC7D7 -18.49 4.15 -10.04 -0.33 0
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219 2332 1 N2C7H8 A2B7C8 42.5 3.23 -9.65 -0.23 0
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220 2336 4 H3C5 A3B5 78.49 0.01 -8.18 -1.2 0
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221 2337 1 NO2C9H11 AB2C9D11 -74.09 4.08 -8.87 -0.26 0
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222 2351 1 ON2C24H34 AB2C24D34 -16.36 4.25 -7.9 0.54 0
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223 2353 1 NO4H18C20 AB4C18D20 -74.84 1.25 0.0 0.0 1
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224 2356 1 O9C14H16 A9B14C16 -349.87 7.14 -9.42 -1.18 0
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225 2361 1 O2H12C19 A2B12C19 7.07 4.37 -9.08 -1.01 0
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226 2363 2 O4C11H11 A4B11C11 -255.51 2.15 -8.7 -0.31 0
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227 2367 1 FPO8C22H30 ABC8D22E30 -465.85 8.41 -9.74 -0.86 0
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228 2369 1 NO3C18H29 AB3C18D29 -112.58 2.51 -8.68 0.22 0
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229 2371 3 OC10H16 AB10C16 -206.22 3.77 -9.56 0.8 0
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230 2372 1 NO4C20H27 AB4C20D27 -127.49 1.23 -8.23 0.25 0
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232 2374 2 OC7H11 AB7C11 -110.42 0.02 -8.3 0.12 0
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233 2376 1 NO6H17C20 AB6C17D20 -150.45 5.93 -8.65 -1.15 0
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234 2377 1 NOC18H23 ABC18D23 -6.67 1.59 -8.72 0.27 0
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235 2379 1 O5H12C16 A5B12C16 -131.56 8.4 -9.13 -1.4 0
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236 2380 1 O3N5C9H11 A3B5C9D11 -67.65 7.55 -10.0 -1.48 0
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237 2382 1 NSO4H19C21 ABC4D19E21 -95.52 4.45 -9.48 -0.61 0
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238 2384 1 O2N8C17H18 A2B8C17D18 86.79 32.94 -5.26 -2.81 2
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239 2387 1 N8H16C17 A8B16C17 129.42 3.99 -9.43 -0.94 0
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240 2389 1 N4O6H20C23 A4B6C20D23 -126.03 3.51 -8.74 -1.36 0
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241 2393 2 NO10C31H33 AB10C31D33 -729.37 10.64 -6.49 -2.24 2
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242 2394 2 NO10C31H32 AB10C31D32 -742.39 9.21 -9.01 -2.02 0
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243 2395 1 SO3N4C16H24 AB3C4D16E24 -111.7 7.52 -9.26 -0.32 0
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244 2396 1 O2N4H24C25 A2B4C24D25 18.43 6.5 -8.44 -1.21 0
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245 2397 1 O2N4H26C27 A2B4C26D27 13.45 9.36 -8.35 -1.22 0
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246 2401 1 O2N4H26C27 A2B4C26D27 9.76 6.73 -8.17 -1.34 0
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247 2403 2 ON2H11C12 AB2C11D12 18.54 6.42 -8.1 -1.34 0
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248 2407 1 SO2Cl4H4C12 AB2C4D4E12 -13.77 3.61 -9.14 -3.06 -2
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249 2412 1 S2N20O21C55H84 A2B20C21D55E84 -737.68 4.95 -7.54 -0.8 0
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250 2414 1 NSO3H15C18 ABC3D15E18 -58.78 3.54 -9.23 -0.96 0
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251 2415 1 ClN2O4C23H23 AB2C4D23E23 -117.86 0.9 -8.65 -0.88 0
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252 2417 1 SO5N6C25H34 AB5C6D25E34 -164.0 11.35 -9.02 -1.37 0
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253 2419 1 N3O3C22H31 A3B3C22D31 -119.28 6.81 -8.46 0.09 0
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254 2428 1 BrN5H10C15 AB5C10D15 119.57 6.68 -8.92 -1.43 0
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255 2429 1 BrO2N5C14H20 AB2C5D14E20 -0.48 3.91 -9.03 -0.3 0
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256 2431 1 BrNC11H17 ABC11D17 37.92 5.24 0.0 0.0 1
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257 2434 2 O7C25H36 A7B25C36 -610.55 8.49 -9.51 -0.54 0
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258 2437 1 ClNO4C19H22 ABC4D19E22 -143.65 5.77 -9.4 -0.39 0
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259 2438 1 ON2C14H18 AB2C14D18 -14.77 3.9 -8.22 -0.1 0
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260 2440 1 BrN4O6C20H25 AB4C6D20E25 -219.46 4.21 -8.99 -0.23 0
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261 2441 1 BrON3H10C14 ABC3D10E14 44.72 3.38 -9.33 -0.95 0
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262 2444 1 BrNOC17H20 ABCD17E20 8.96 2.72 -8.91 -0.2 0
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263 2450 1 BrNC3O4H6 ABC3D4E6 -109.27 2.43 -11.19 -1.85 0
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264 2453 1 NOBr2H5C9 ABC2D5E9 12.77 3.42 -9.08 -1.28 0
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265 2457 1 N3H11C12 A3B11C12 75.16 1.39 -9.09 -0.95 0
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266 2458 1 NO2C20H25 AB2C20D25 -62.99 2.9 -9.14 -0.73 0
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267 2460 1 PN5O8C18H24 AB5C8D18E24 -346.55 2.47 -9.71 -1.22 0
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268 2461 1 N2O3C14H22 A2B3C14D22 -165.82 3.19 -10.57 -0.52 0
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269 2466 1 NO3C12H17 AB3C12D17 -92.04 4.11 -9.04 -0.14 0
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270 2467 1 NO4C17H25 AB4C17D25 -151.04 4.49 -8.59 0.23 0
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271 2471 1 SN2O5C17H20 AB2C5D17E20 -154.05 8.55 -9.06 -1.31 0
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272 2472 1 O3N5C19H27 A3B5C19D27 -79.66 3.09 -8.01 -0.35 0
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273 2473 2 NOC7H10 ABC7D10 -52.41 4.64 -8.96 -0.73 0
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274 2479 1 N2O3C10H16 A2B3C10D16 -158.72 2.38 -10.95 -0.66 0
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275 2481 1 N2O3C11H16 A2B3C11D16 -138.55 1.99 -10.81 -0.64 0
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276 2484 1 NC23H27 AB23C27 42.13 1.37 -8.63 -0.29 0
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277 2485 1 N5O12C21H41 A5B12C21D41 -516.68 9.65 -9.29 -0.22 0
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278 2486 1 NO5C16H29 AB5C16D29 -279.26 8.42 -10.06 0.01 0
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279 2487 1 NO2C21H29 AB2C21D29 -86.33 1.88 -8.65 0.04 0
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280 2488 1 NO4C28H38 AB4C28D38 -142.46 1.76 0.0 0.0 1
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281 2489 1 PN2O6C17H35 AB2C6D17E35 -350.57 6.05 -9.76 0.59 0
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282 2497 2 N2C17H24 A2B17C24 50.56 4.24 -6.72 -0.13 2
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283 2498 1 NO3C34H67 AB3C34D67 -259.04 3.07 -9.8 0.44 0
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284 2499 1 NPO7C26H54 ABC7D26E54 -449.68 10.53 -9.51 -0.04 0
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285 2501 1 NPO7C28H58 ABC7D28E58 -449.01 15.9 -9.28 -0.36 0
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286 2502 1 NPO7C28H59 ABC7D28E59 -444.0 6.14 0.0 0.0 1
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287 2505 1 NO3C20H39 AB3C20D39 -201.55 5.24 -9.89 0.63 0
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288 2506 1 NO3C20H41 AB3C20D41 -220.18 2.81 -9.87 0.9 0
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289 2511 2 NO4C19H36 AB4C19D36 -467.38 12.46 -8.86 0.43 0
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290 2513 1 AsC2O2H7 AB2C2D7 -59.44 3.82 -9.81 0.31 0
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291 2521 1 N2O13H26C30 A2B13C26D30 -456.76 14.26 -9.49 -2.25 0
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292 2523 1 O3C28H42 A3B28C42 -132.19 1.72 -8.63 0.08 0
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293 2524 1 O3C27H44 A3B27C44 -184.16 2.86 -8.67 0.11 0
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294 2525 2 IOC9H17 ABC9D17 -139.16 7.87 -9.69 -0.88 0
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295 2526 1 PC3O6H9 AB3C6D9 -346.61 4.29 -10.87 0.54 0
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297 2533 2 O7H19C22 A7B19C22 -443.1 4.85 -8.64 -2.13 0
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298 2534 1 PN4O15C50H81 AB4C15D50E81 -705.73 3.11 -9.1 0.1 0
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299 2535 1 O5H14C16 A5B14C16 -145.04 3.17 -8.74 -0.74 0
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300 2537 1 OC10H16 AB10C16 -59.82 3.44 -9.58 0.88 0
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301 2541 1 O3N6H20C24 A3B6C20D24 43.77 3.4 -8.98 -0.91 0
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302 2544 1 O5C10H14 A5B10C14 -216.61 8.37 -10.98 0.1 0
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303 2549 1 ClSN2O2C19H21 ABC2D2E19F21 -43.65 3.98 -8.69 -0.16 0
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304 2550 1 NSO3C9H15 ABC3D9E15 -149.29 5.82 -9.22 0.18 0