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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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44270 10502321 1 BrNOC24H24 ABCD24E24 30.5 2.77 -7.01 -0.04 0
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44271 10502323 1 O12C17H24 A12B17C24 -488.68 7.96 -10.42 -0.92 0
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44272 10502327 1 SN4O7C17H18 AB4C7D17E18 -137.63 2.83 -9.94 -1.72 0
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44273 10502330 1 SN2F3O3H17C20 AB2C3D3E17F20 -166.84 3.49 -8.86 -1.57 0
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44274 10502359 1 SiO5C23H38 AB5C23D38 -210.09 2.88 -8.57 0.38 0
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44275 10502360 1 SiO3C26H34 AB3C26D34 -112.82 2.23 -9.03 -0.18 0
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44276 10502363 1 SSiO2C25H30 ABC2D25E30 -53.25 6.51 -8.27 -0.12 1
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44277 10502377 1 N3C19H26 A3B19C26 63.67 1.56 0.0 0.0 0
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44278 10502382 1 FSN3O6C18H18 ABC3D6E18F18 -154.85 7.48 -9.36 -1.05 0
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44279 10502397 1 FN3O3C24H26 AB3C3D24E26 -109.64 8.84 -8.79 -0.72 0
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44280 10502401 1 SN7H17C23 AB7C17D23 219.21 3.83 -8.94 -1.32 0
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44281 10502402 1 NO5C25H29 AB5C25D29 -154.77 4.98 -8.03 -0.39 0
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44282 10502467 1 SSiO3C23H40 ABC3D23E40 -220.99 7.88 -8.63 -0.41 0
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44283 10502494 1 NPO5C22H36 ABC5D22E36 -306.28 2.84 -8.87 -0.24 0
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44284 10502500 1 NSO6C21H31 ABC6D21E31 -293.8 2.3 -8.84 -0.51 0
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44285 10502503 1 SN3O3C23H27 AB3C3D23E27 -67.52 1.7 -8.44 -0.05 0
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44286 10502511 1 NSO2C26H35 ABC2D26E35 -94.6 2.5 -8.55 -0.2 0
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44287 10502519 1 PN2O3Cl4C13H21 AB2C3D4E13F21 -211.77 4.03 -9.66 -0.21 0
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44289 10502523 1 SN2O2C19H19 AB2C2D19E19 33.12 3.04 0.0 0.0 0
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44290 10502529 2 NO4C10H15 AB4C10D15 -303.87 2.36 -9.69 -0.9 0
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44291 10502537 1 SN2O5C22H22 AB2C5D22E22 -91.6 4.63 -9.3 -0.57 0
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44292 10502545 2 ON2C13H13 AB2C13D13 18.78 7.81 -8.98 -0.31 0
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44293 10502550 1 SO2N6C21H26 AB2C6D21E26 25.02 1.98 -8.03 -1.18 0
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44294 10502559 1 O4C27H38 A4B27C38 -186.89 3.98 -8.88 -0.52 0
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44295 10502561 1 SiO6C22H38 AB6C22D38 -340.47 2.86 -9.18 -1.44 0
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44296 10502573 1 ClN2F6H9C20 AB2C6D9E20 -213.67 4.89 -9.95 -2.04 0
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44297 10502577 1 ClN2S2O5H15C17 AB2C2D5E15F17 -87.81 9.58 -8.84 -1.64 0
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44298 10502578 1 ClON4H19C25 ABC4D19E25 100.81 1.87 -9.04 -1.08 1
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44299 10502583 1 O2S2N6H11C13 A2B2C6D11E13 121.0 4.76 0.0 0.0 0
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44300 10502591 1 NO7C23H25 AB7C23D25 -211.94 2.72 -8.04 -0.72 0
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44301 10502593 1 N5O5C21H25 A5B5C21D25 -134.65 10.18 -9.06 -1.24 0
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44302 10502610 1 NSO4C24H29 ABC4D24E29 -130.14 7.09 -9.34 -0.99 0
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44303 10502616 1 NPSiO4C21H38 ABCD4E21F38 -285.7 2.87 -8.8 0.32 0
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44304 10502617 1 NOSC28H29 ABCD28E29 29.38 4.84 -8.75 -0.57 0
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44305 10502618 1 NOSSiC25H37 ABCDE25F37 -58.37 5.6 -8.59 -0.13 0
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44306 10502619 1 ClSF3N3O5H13C14 ABC3D3E5F13G14 -297.57 3.15 -9.65 -0.9 0
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44308 10502632 2 N2O3H6C11 A2B3C6D11 0.96 0.68 -9.61 -2.77 0
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44309 10502649 2 NO2H12C13 AB2C12D13 -93.74 2.0 -8.55 -0.14 0
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44310 10502650 2 NO2H12C13 AB2C12D13 -22.24 7.39 -9.27 -1.27 0
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44311 10502657 4 OC7H7 AB7C7 -40.87 2.32 -9.4 0.09 0
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44312 10502659 1 N2O3C27H28 A2B3C27D28 -53.52 4.65 -8.96 -0.7 0
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44313 10502660 1 N2O3C27H28 A2B3C27D28 -57.71 1.1 -8.52 -0.27 0
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44314 10502666 1 SiF3O3C22H31 AB3C3D22E31 -311.23 4.01 -9.08 -0.36 0
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44315 10502683 1 NSCl3O3H12C18 ABC3D3E12F18 -90.1 11.05 -9.5 -1.25 0
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44316 10502690 1 ClSiO4C23H25 ABC4D23E25 -166.83 5.1 -8.6 -1.86 0
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44317 10502692 1 SnO2C20H38 AB2C20D38 -56.3 2.03 -9.23 0.3 0
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44318 10502703 1 N3O6C22H27 A3B6C22D27 -216.52 4.48 -9.61 -0.06 0
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44319 10502714 1 NO8C21H35 AB8C21D35 -393.26 3.83 -9.88 0.39 0
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44320 10502717 1 S2N3O6C17H23 A2B3C6D17E23 -155.3 8.52 -9.2 -1.57 0
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44321 10502755 1 ON4H22C28 AB4C22D28 142.3 4.72 -8.59 -1.05 0
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44322 10502757 1 ON8C23H26 AB8C23D26 124.1 2.29 -8.68 -0.76 0
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44323 10502763 1 ON6C25H30 AB6C25D30 66.58 6.39 -8.78 -0.67 0
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44324 10502764 1 OS2N4H18C23 AB2C4D18E23 113.23 6.15 -8.12 -1.59 0
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44325 10502768 1 SiN2O7C19H34 AB2C7D19E34 -380.4 6.45 -9.05 -0.55 0
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44326 10502769 1 O3C29H34 A3B29C34 -111.23 3.91 -8.66 -0.32 0
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44327 10502773 1 ON4C27H34 AB4C27D34 -8.4 4.67 -8.23 0.19 0
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44328 10502777 1 O3C28H46 A3B28C46 -188.38 4.67 -8.57 0.22 0
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44329 10502780 1 N2O2C27H46 A2B2C27D46 -131.63 5.53 -9.0 0.24 0
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44330 10502786 1 BrOF4N4H11C16 ABC4D4E11F16 -122.79 4.77 -10.23 -1.3 0
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44331 10502788 1 H5C7 A5B7 110.19 0.7 0.0 0.0 0
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44332 10502792 1 BrON6C19H23 ABC6D19E23 24.02 2.84 -8.44 -0.61 0
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44333 10502793 1 PN7O7C14H22 AB7C7D14E22 -306.47 11.92 -9.39 -0.27 0
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44334 10502799 1 NO8C22H25 AB8C22D25 -213.56 3.52 -8.78 -1.5 0
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44335 10502843 1 BrNSO2C21H22 ABCD2E21F22 -28.62 2.03 -9.35 -0.7 0
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44336 10502863 1 SO3N4H20C23 AB3C4D20E23 -13.38 7.96 -7.81 -0.62 0
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44337 10502876 1 O6C25H36 A6B25C36 -265.4 6.32 -9.72 -0.69 0
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44338 10502909 1 SN3O7C19H19 AB3C7D19E19 -183.05 7.9 -9.64 -0.92 0
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44339 10502921 1 NO5C26H27 AB5C26D27 -140.82 2.54 -9.47 -0.49 0
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44340 10502936 1 NO3S3C21H23 AB3C3D21E23 -74.07 2.54 -8.78 -0.48 0
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44341 10502940 1 NSi2O3C23H39 AB2C3D23E39 -213.01 3.44 -8.94 0.26 0
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44342 10502942 1 ClOSF2N5H14C19 ABCD2E5F14G19 12.95 6.54 -9.47 -1.38 0
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44343 10502943 1 ClNSO5H20C21 ABCD5E20F21 -133.96 10.18 -8.37 -1.11 2
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44344 10502945 1 FeNSeO2C19H25 ABCD2E19F25 -45.49 4.67 -8.37 -0.04 0
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44345 10502946 1 NSeO2C14H20 ABC2D14E20 -44.65 5.89 0.0 0.0 0
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44346 10502962 1 N2O8C21H26 A2B8C21D26 -314.7 2.28 -9.81 -0.45 0
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44347 10502965 1 O8C23H30 A8B23C30 -302.66 2.86 -8.38 -0.12 0
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44348 10502986 2 ON2C13H17 AB2C13D17 -35.95 6.35 -8.56 -0.34 0
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44349 10502998 1 ClON2H19C28 ABC2D19E28 100.25 2.8 -9.13 -0.94 0
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44350 10502999 1 ClSSiF3O5C15H22 ABCD3E5F15G22 -214.31 17.97 -10.41 -1.94 0
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44351 10503016 1 N5H17C29 A5B17C29 196.45 3.5 -8.87 -1.14 0
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44353 10503048 1 ISiO2C18H33 ABC2D18E33 -158.25 2.88 -8.84 -1.26 0
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44354 10503057 1 N4O5C23H24 A4B5C23D24 -89.26 3.27 -8.73 -2.1 0
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44355 10503059 1 O4N10C17H28 A4B10C17D28 -84.84 6.81 -9.04 -1.03 0
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44356 10503061 1 SO6H20C24 AB6C20D24 -141.87 6.84 -8.62 -2.11 0
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44357 10503079 1 O3H28C30 A3B28C30 -46.76 3.48 -8.53 -0.55 0
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44358 10503107 1 ClFSN4H18C23 ABCD4E18F23 95.6 2.85 -8.87 -1.13 0
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44359 10503127 1 N3O4C25H31 A3B4C25D31 -143.1 2.65 -9.13 -0.24 0
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44360 10503128 1 S2N3O5C19H23 A2B3C5D19E23 -114.25 2.12 -8.85 -1.13 0
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44361 10503136 1 N3O5C23H39 A3B5C23D39 -236.94 6.18 -9.13 -0.15 0
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44362 10503142 1 ON5C26H39 AB5C26D39 -5.44 7.26 -8.74 -0.5 0
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44363 10503146 1 ClNF2O3C23H26 ABC2D3E23F26 -199.29 9.07 -8.75 -0.35 0
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44364 10503155 1 SO3C18H21 AB3C18D21 -58.45 3.19 0.0 0.0 0
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44365 10503162 1 N2O5C25H30 A2B5C25D30 -187.71 6.07 -8.78 0.06 0
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44366 10503163 1 FSO2N4C23H23 ABC2D4E23F23 5.85 13.61 -7.84 -1.99 1
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44367 10503164 1 FSO2N4C23H24 ABC2D4E23F24 -12.79 6.08 0.0 0.0 0
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44368 10503172 2 FN2C13H16 AB2C13D16 -56.45 0.55 -8.24 -0.35 0
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44369 10503195 1 Cl2N2O2S2H16C19 A2B2C2D2E16F19 -3.38 0.61 -9.24 -0.7 0
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44370 10503212 1 S2N3O3H21C22 A2B3C3D21E22 -57.05 3.03 -8.56 -0.91 0
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44371 10503250 1 N4O5C23H28 A4B5C23D28 -93.27 4.75 -9.33 -0.02 0
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44372 10503252 1 O2N6H24C25 A2B6C24D25 61.66 2.44 -9.31 -0.58 0