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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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221253 85261711 1 O11C28H44 A11B28C44 -527.09 5.27 -10.13 -0.49 0
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221256 85261723 2 BrPH12C13 ABC12D13 86.11 3.19 -8.57 -0.58 0
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221257 85261728 1 SN2O5C32H36 AB2C5D32E36 -142.4 5.44 -9.05 -0.03 0
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221259 85261731 3 O3C10H18 A3B10C18 -425.33 5.82 -8.83 0.18 0
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221260 85261745 4 O3C7H8 A3B7C8 -466.51 0.29 -8.38 -0.21 0
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221261 85261750 1 Si2O3C34H48 A2B3C34D48 -152.83 2.72 -8.99 0.26 0
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221262 85261761 1 O8C33H38 A8B33C38 -273.49 1.54 -9.39 -0.03 0
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221264 85261768 1 PSSiN3O8C22H38 ABCD3E8F22G38 -396.01 7.58 -8.8 -0.86 0
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221265 85266879 2 O2C11H16 A2B11C16 -199.09 6.38 -9.33 -0.09 0
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221266 85267002 1 O5C22H22 A5B22C22 -124.83 2.76 -9.85 -0.69 0
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221267 85267026 1 O3N5C19H25 A3B5C19D25 -22.98 6.73 -8.28 -0.14 0
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221268 85267074 1 S2N3O5C14H15 A2B3C5D14E15 -142.76 5.84 -9.06 -1.38 0
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221269 85267075 1 O2N7C18H27 A2B7C18D27 -11.89 4.43 -8.24 -0.04 0
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221270 85267076 1 O2S2F3N3C13H18 A2B2C3D3E13F18 -204.02 4.81 -8.92 -1.37 0
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221271 85267077 1 NO4C22H27 AB4C22D27 -135.94 3.86 -8.6 0.15 0
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221272 85267078 1 NO4C22H27 AB4C22D27 -124.46 3.83 -9.31 -0.12 0
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221273 85267079 1 NO2H23C25 AB2C23D25 -9.98 3.89 -8.93 -0.51 0
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221274 85267080 1 ON3H23C24 AB3C23D24 94.27 5.64 -9.05 -0.5 0
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221275 85267082 1 NO5C20H35 AB5C20D35 -196.78 4.55 -8.54 0.05 0
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221276 85267083 1 NO3C23H31 AB3C23D31 -101.84 2.15 -8.72 -0.15 0
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221277 85267084 1 NO3C23H31 AB3C23D31 -96.73 5.67 -9.25 -0.15 0
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221278 85267085 1 NSiO5C18H31 ABC5D18E31 -233.94 2.47 -9.0 -0.49 0
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221279 85267087 1 O2N3C21H43 A2B3C21D43 -107.35 5.84 -9.78 0.09 0
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221280 85267088 1 ClN5O5C14H16 AB5C5D14E16 -162.83 6.81 -9.07 -0.79 0
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221281 85267089 2 BrNC7H7 ABC7D7 61.15 1.14 -9.65 -1.25 0
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221282 85267090 1 ISO2H11C14 ABC2D11E14 8.87 5.16 -9.45 -1.3 0
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221283 85267091 1 ISiO2C13H27 ABC2D13E27 -142.54 1.87 -9.1 -0.63 0
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221284 85267092 1 N2O6H18C19 A2B6C18D19 -125.33 3.87 -9.72 -1.34 0
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221285 85267093 1 PF2O5C16H29 AB2C5D16E29 -411.33 3.42 -9.98 0.5 0
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221287 85267095 1 O3N6C18H22 A3B6C18D22 -14.62 8.54 -9.36 -1.38 0
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221288 85267096 2 NO3C9H15 AB3C9D15 -299.43 7.17 -9.79 -0.13 0
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221289 85267097 1 N2O4C21H26 A2B4C21D26 -23.52 2.26 -8.3 -0.38 0
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221290 85267101 1 ON2C25H26 AB2C25D26 8.26 3.43 -9.1 -0.45 0
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221291 85267102 1 O3C24H34 A3B24C34 -114.66 6.29 -9.48 -0.54 0
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221292 85267103 1 SO2C23H30 AB2C23D30 -48.46 4.03 -7.86 0.17 0
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221293 85267413 4 O2C5H6 A2B5C6 -301.16 3.49 -8.19 -0.7 0
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221294 85267512 1 NSO4H17C22 ABC4D17E22 -57.05 5.02 -9.73 -0.62 0
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221295 85267513 1 SN3O3H17C21 AB3C3D17E21 1.42 5.73 -9.17 -0.88 0
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221296 85267529 1 O6H20C23 A6B20C23 -173.49 8.4 -8.89 -1.2 0
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221298 85267543 1 BrO4C19H21 AB4C19D21 -129.18 1.58 -9.69 -0.26 0
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221299 85267546 1 NO4C24H27 AB4C24D27 -131.7 3.93 -9.6 -0.47 0
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221301 85267548 1 NO3C25H31 AB3C25D31 -79.71 1.45 -9.16 0.25 0
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221302 85267550 1 NSO2C23H39 ABC2D23E39 -123.46 5.66 -9.43 -0.2 0
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221303 85267554 2 NO3C10H15 AB3C10D15 -236.48 4.01 -8.62 0.33 0
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221304 85267555 1 N2O4C23H26 A2B4C23D26 -116.65 5.49 -9.23 0.0 0
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221305 85267557 2 O3C11H17 A3B11C17 -306.82 4.72 -9.08 -0.05 0
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221306 85267580 1 N3O4C22H25 A3B4C22D25 -70.06 2.24 -9.57 -0.45 0
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221307 85267585 1 NO2H25C27 AB2C25D27 4.4 4.32 -7.92 -0.67 0
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221308 85267591 1 OF3N4H15C21 AB3C4D15E21 -26.28 11.8 -9.3 -2.0 0
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221309 85267592 1 N2O5C22H24 A2B5C22D24 -168.7 2.42 -9.55 -0.15 0
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221310 85267593 1 N2O3C25H28 A2B3C25D28 -88.53 8.82 -9.37 -0.47 0
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221311 85267594 1 N4O4C21H24 A4B4C21D24 -75.35 3.8 -8.95 -0.67 0
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221312 85267596 1 O5C24H28 A5B24C28 -113.65 4.72 -9.21 -1.45 1
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221313 85267609 1 N5O5C19H20 A5B5C19D20 -123.0 5.95 0.0 0.0 0
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221314 85267617 1 SN3O5C18H27 AB3C5D18E27 -195.29 3.38 -9.25 -1.15 0
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221315 85267627 1 O7C22H22 A7B22C22 -241.85 8.45 -9.06 -1.2 0
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221316 85267631 1 SO9C16H30 AB9C16D30 -398.24 5.32 -9.49 0.12 0
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221317 85267640 2 SO2C10H15 AB2C10D15 -168.57 2.89 -8.65 0.29 0
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221318 85267641 1 SO2C25H34 AB2C25D34 -58.56 2.96 -8.32 0.02 0
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221319 85267642 1 SN2O3C21H38 AB2C3D21E38 -200.08 6.45 -9.21 -0.1 0
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221320 85267643 1 SiO3C24H34 AB3C24D34 -167.83 1.29 -9.02 0.08 0
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221321 85267648 1 N5O6H17C18 A5B6C17D18 -106.46 10.34 -9.31 -1.82 0
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221322 85267654 1 N3O4C22H29 A3B4C22D29 -135.53 4.46 -9.37 -0.16 0
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221323 85267663 1 NOSiC26H29 ABCD26E29 6.36 3.07 -9.24 -0.23 0
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221324 85267667 1 ClSO4N5C15H18 ABC4D5E15F18 -132.92 2.8 -9.19 -1.34 0
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221325 85267669 1 BrNO2C21H22 ABC2D21E22 -34.4 4.69 -9.44 -1.08 0
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221326 85267674 1 SN2O2H20C24 AB2C2D20E24 39.89 2.56 -8.63 -0.78 0
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221327 85267696 1 NOSH15C27 ABCD15E27 102.58 6.64 -8.74 -1.41 0
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221328 85267702 1 NO2C26H43 AB2C26D43 -150.78 3.09 -8.49 0.78 0
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221330 85267705 1 BrNO5C17H24 ABC5D17E24 -115.11 5.44 -9.58 -0.79 0
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221331 85267709 2 N2O2H10C11 A2B2C10D11 -48.38 5.14 -9.58 -1.42 0
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221332 85267710 1 O7C22H26 A7B22C26 -89.98 5.71 -9.61 0.14 0
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221333 85267712 1 N2O6C21H26 A2B6C21D26 -239.46 3.47 -9.68 -0.22 0
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221334 85267714 1 O4N6C19H26 A4B6C19D26 -137.46 4.66 -9.27 -0.73 0
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221335 85267715 1 PN2O3C22H31 AB2C3D22E31 -154.24 6.87 -8.97 -0.15 0