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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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24271 608910 1 NOC25H25 ABC25D25 40.38 1.72 -8.73 0.19 0
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24272 608953 1 NO2F3H4C8 AB2C3D4E8 -194.06 4.32 -9.66 -1.01 0
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24273 608962 1 BrO4C13H15 AB4C13D15 -158.62 1.28 -9.4 -1.04 0
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24274 608976 1 OC8H10 AB8C10 -10.97 1.61 -8.06 0.11 -6
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24275 608981 1 N2O2F3H5C9 A2B2C3D5E9 -111.36 5.73 -11.27 -2.0 0
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24276 608984 1 ClFSH4O4C7 ABCD4E4F7 -185.74 5.06 -11.59 -1.99 0
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24277 609021 1 NSC12H13 ABC12D13 40.27 1.66 -9.07 -0.75 0
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24278 609032 1 OCl2N2H8C12 AB2C2D8E12 31.81 2.65 -9.94 -1.01 0
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24279 609041 1 OB2N2C12H22 AB2C2D12E22 -143.94 4.55 -8.75 -0.17 0
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24280 609062 4 H3C4 A3B4 123.4 0.41 -9.14 0.42 0
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24281 609068 1 ClH2N4F7C8 AB2C4D7E8 -252.61 6.31 -10.62 -2.0 0
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24282 609069 1 O2Cl3H5C8 A2B3C5D8 -72.29 4.75 -9.53 -1.53 0
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24283 609074 1 NSCl2O4C17H17 ABC2D4E17F17 -161.27 2.84 -8.73 -1.12 0
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24284 609075 1 OCl2H3N3C6 AB2C3D3E6 62.57 3.68 -8.86 -1.76 0
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24285 609082 1 NSCl2O4C19H19 ABC2D4E19F19 -163.27 3.59 -8.47 -1.34 0
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24286 609086 6 C3H5 A3B5 -53.31 0.12 -9.43 1.46 0
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24287 609094 2 SiC8H13 AB8C13 -42.21 0.86 -8.62 0.48 0
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24288 609106 1 PC15H25 AB15C25 -26.58 1.74 -9.04 0.54 0
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24289 609107 1 N4O4C25H40 A4B4C25D40 -180.21 3.2 -8.12 0.0 0
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24290 609110 1 NSO3H11C12 ABC3D11E12 -73.75 4.7 -9.19 -1.04 0
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24291 609112 1 O5C31H50 A5B31C50 -294.72 4.32 -9.19 1.02 0
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24292 609114 1 O5C31H48 A5B31C48 -263.16 3.43 -9.18 0.13 0
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24293 609116 1 O3C31H48 A3B31C48 -196.93 3.19 -9.16 0.88 0
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24294 609129 1 N2O2C17H24 A2B2C17D24 -62.9 1.62 -7.65 -0.38 0
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24295 609130 1 NOS2F3H8C11 ABC2D3E8F11 -154.79 4.42 -9.31 -1.46 0
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24296 609134 1 BrON2H15C19 ABC2D15E19 54.38 4.67 -9.37 -1.35 0
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24297 609149 1 N2O3H20C23 A2B3C20D23 -12.07 3.31 -8.12 -0.6 0
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24299 609154 1 ClN2O2F3H14C18 AB2C2D3E14F18 -177.23 6.86 -8.35 -0.81 0
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24300 609157 1 BrON2H21C22 ABC2D21E22 19.76 5.29 -9.31 -1.2 0
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24301 609180 1 O2N4H8C9 A2B4C8D9 82.31 0.79 -10.09 -1.51 0
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24302 609196 1 Si3O5C16H38 A3B5C16D38 -397.95 1.38 -9.6 1.26 0
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24303 609197 1 Si4O5C19H42 A4B5C19D42 -443.72 1.94 -9.68 0.21 0
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24304 609199 1 Si3O7C38H68 A3B7C38D68 -524.28 3.8 -9.67 -0.45 0
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24305 609200 1 Si4O8C41H76 A4B8C41D76 -625.6 5.33 -9.56 -0.38 0
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24306 609202 1 Si3O6C17H40 A3B6C17D40 -433.16 1.3 -9.57 1.22 0
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24307 609204 1 Si4O6C19H46 A4B6C19D46 -494.84 2.0 -9.59 1.08 0
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24308 609218 1 N3H11C15 A3B11C15 127.2 2.01 -8.9 -0.86 0
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24309 609230 1 ON3F6H15C17 AB3C6D15E17 -301.05 6.6 -9.15 -0.32 0
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24310 609233 1 F3N3O3C12H14 A3B3C3D12E14 -260.07 4.66 -9.09 -0.28 0
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24311 609236 3 C5H8 A5B8 -25.18 0.36 -8.64 1.64 0
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24312 609245 1 PC13H17 AB13C17 -4.65 1.27 -8.5 0.56 0
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24313 609247 1 NO2C15H23 AB2C15D23 -84.46 5.45 -9.79 -0.14 0
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24314 609250 1 N3H11C15 A3B11C15 158.46 4.94 -9.32 -0.59 0
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24315 609262 1 N2O3H8C10 A2B3C8D10 -26.22 1.71 -9.83 -1.58 0
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24316 609263 1 BrNO4C24H28 ABC4D24E28 -157.47 5.32 -9.39 -0.14 0
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24317 609278 1 N2O2C11H12 A2B2C11D12 -42.93 6.31 -9.62 -0.85 0
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24318 609292 1 OSN2H16C18 ABC2D16E18 36.86 3.79 -9.0 -0.8 0
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24319 609303 1 O4H8C11 A4B8C11 -108.69 2.75 -9.79 -2.02 0
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24320 609310 1 O4C13H16 A4B13C16 -165.28 1.47 -9.76 -0.03 0
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24321 609322 1 NCl2F6H7C8 AB2C6D7E8 -323.55 1.36 -10.44 -0.12 0
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24322 609323 1 OBr2H16C23 AB2C16D23 65.33 2.83 -9.37 -1.12 0
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24323 609329 1 ON2F3H7C8 AB2C3D7E8 -136.63 3.28 -9.4 -0.95 0
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24324 609332 1 NO4H15C18 AB4C15D18 -47.43 5.76 -9.5 -0.68 0
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24325 609340 1 SN4H8C9 AB4C8D9 86.29 2.45 -9.15 -1.41 0
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24326 609341 1 SN2C11H12 AB2C11D12 53.89 5.39 -9.11 -0.9 0
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24327 609342 10 C3H5 A3B5 -87.3 0.57 -8.97 1.64 0
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24328 609344 1 C19H30 A19B30 -46.68 0.48 -9.36 1.54 0
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24329 609345 1 O3C32H54 A3B32C54 -216.36 0.93 -8.79 0.9 0
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24330 609348 1 Si7O10C33H78 A7B10C33D78 -837.49 2.36 -9.52 0.16 0
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24331 609355 2 BrH6C8 AB6C8 55.06 2.98 -8.41 -1.54 0
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24332 609356 1 OH12C17 AB12C17 46.58 3.6 -9.27 -0.68 0
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24333 609359 1 N2O3H8C10 A2B3C8D10 -5.71 11.28 -9.49 -1.31 0
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24334 609360 2 N2O2C9H9 A2B2C9D9 73.28 0.3 -10.38 -1.64 0
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24335 609372 1 NC19H19 AB19C19 52.97 4.26 -9.37 -0.01 0
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24336 609373 1 N2O2C17H24 A2B2C17D24 -83.45 5.82 -8.93 -0.41 0
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24337 609405 1 NO3C17H23 AB3C17D23 -126.68 3.48 -8.76 -0.46 0
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24338 609423 1 O2N3C13H17 A2B3C13D17 -75.12 2.69 -9.41 -1.25 0
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24339 609425 1 NSO2H15C18 ABC2D15E18 11.16 2.03 -9.14 -1.7 0
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24340 609430 1 SO2H12C16 AB2C12D16 -7.8 5.7 -9.26 -0.63 0
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24341 609431 1 NSO2H11C15 ABC2D11E15 34.75 7.25 -8.91 -0.6 0
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24342 609442 1 SO2N5H15C17 AB2C5D15E17 102.8 5.42 -8.86 -1.42 0
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24343 609468 1 O2N5H7C8 A2B5C7D8 102.09 3.64 -9.98 -2.16 0
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24344 609469 1 Si2O4N5C24H45 A2B4C5D24E45 -261.78 1.77 -8.88 -0.66 0
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24345 609470 1 O5C14H18 A5B14C18 -202.01 4.84 -9.4 -0.25 0
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24346 609473 1 MnNC22H26 ABC22D26 178.28 14.16 -5.59 -2.64 -11
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24347 609487 1 OSiC13H20 ABC13D20 -75.09 0.33 -9.29 0.37 0
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24348 609496 1 O6C11H22 A6B11C22 -246.77 3.89 -9.19 1.2 0
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24349 609502 1 BNC13H24 ABC13D24 -73.0 1.99 -8.99 1.8 0
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24350 609504 1 O2S3N6C7H8 A2B3C6D7E8 74.89 4.3 -8.79 -1.03 0
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24351 609508 10 C3H5 A3B5 -75.25 0.51 -8.52 1.76 0
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24352 609513 1 N2O3C16H24 A2B3C16D24 -108.03 2.96 -8.51 0.1 0
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24353 609520 1 OC19H32 AB19C32 -109.35 2.48 -8.92 1.44 0
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24354 609544 1 OC16H28 AB16C28 12.42 2.18 -9.03 2.87 0
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24355 609570 1 BrOH11C16 ABC11D16 25.47 3.37 -8.66 -1.4 0
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24356 609571 1 OS2N4H18C19 AB2C4D18E19 11.17 3.34 -7.77 -0.76 0
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24358 609591 1 GeSC11H25 ABC11D25 -14.87 2.2 0.0 0.0 -1
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24359 609617 2 NO2C10H12 AB2C10D12 -84.03 5.26 -8.41 -0.51 0
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24360 609618 1 NH11C15 AB11C15 73.07 2.8 -9.08 -0.84 0
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24361 609625 1 SN2C11H14 AB2C11D14 29.55 2.8 -8.4 -0.08 0
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24362 609674 1 ON6C10H14 AB6C10D14 32.55 1.22 -9.55 -0.7 0
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24363 609676 2 OC9H9 AB9C9 -46.1 1.71 -8.34 -1.12 0
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24365 609686 1 ClO4H11C12 AB4C11D12 -136.78 6.94 -9.23 -1.61 0
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24366 609691 2 N3H5C7 A3B5C7 178.29 5.93 -9.69 -1.5 0
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24367 609692 1 ClNO2C14H14 ABC2D14E14 -50.77 2.63 -8.46 -0.75 0
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24368 609695 1 SO2N4H10C14 AB2C4D10E14 63.67 8.04 -9.36 -1.47 0
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24369 609733 1 NCl2O2C18H19 AB2C2D18E19 -48.9 4.48 -8.25 -0.4 0
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24370 609739 1 FN2O2C15H19 AB2C2D15E19 -110.67 6.98 -8.74 -0.68 0
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24371 609741 1 BrNO3C18H20 ABC3D18E20 -72.47 4.12 -8.13 -0.31 0
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24372 609745 1 FSN2O2C18H19 ABC2D2E18F19 -74.23 4.57 -8.85 -0.69 0
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24373 609765 1 ClS2O4C8H9 AB2C4D8E9 -150.23 2.64 -10.6 -1.3 0