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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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307221 125292609 1 O2N6C25H34 A2B6C25D34 -10.67 4.09 -8.52 -0.85 0
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307222 125292610 1 O2N6C25H34 A2B6C25D34 -10.87 3.65 -8.53 -0.84 0
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307223 125292611 1 O2N6C25H34 A2B6C25D34 -11.24 7.2 -8.57 -0.85 0
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307224 125292612 1 OSN3H13C14 ABC3D13E14 50.43 5.77 -9.44 -1.82 0
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307225 125292615 1 N2C11H14 A2B11C14 39.32 3.49 -9.14 -0.33 0
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307226 125292616 1 N2C11H14 A2B11C14 38.91 3.65 -9.14 -0.32 0
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307227 125292617 1 OSN6C20H20 ABC6D20E20 112.56 6.0 -8.86 -1.43 0
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307228 125292619 1 O2N3C16H17 A2B3C16D17 -17.05 3.4 -9.02 -1.1 0
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307229 125292621 1 O2N3C16H17 A2B3C16D17 -15.75 4.71 -9.01 -1.08 1
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307231 125292627 1 ON4H8C9 AB4C8D9 48.78 4.82 -10.13 -1.28 0
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307232 125292628 1 FNO3H10C13 ABC3D10E13 -89.52 6.64 -9.94 -2.09 0
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307233 125292630 1 O3N4C16H18 A3B4C16D18 18.23 4.61 -9.42 -1.29 0
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307234 125292635 1 SO3N5H23C25 AB3C5D23E25 27.92 6.14 -8.42 -1.24 0
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307235 125292636 1 SO3N5H13C16 AB3C5D13E16 66.0 6.15 -8.75 -1.51 0
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307236 125292642 3 NO2C11H13 AB2C11D13 -169.15 13.7 -8.44 -1.24 0
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307237 125292652 1 FN3H12C18 AB3C12D18 84.77 4.56 -9.26 -1.53 0
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307239 125292656 1 O3N4H12C13 A3B4C12D13 -8.57 3.6 -9.09 -1.13 0
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307240 125292657 1 N3O4C16H19 A3B4C16D19 -144.09 2.66 -8.47 -0.35 0
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307241 125292658 1 N2O4H26C27 A2B4C26D27 -79.0 7.46 -8.81 -1.17 0
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307242 125292699 1 SO3N5C22H25 AB3C5D22E25 -5.83 2.67 -8.77 -1.32 0
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307244 125292936 1 O2N4H22C23 A2B4C22D23 35.07 4.48 -8.32 -2.07 0
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307245 125292950 1 S3O4N8C31H32 A3B4C8D31E32 -39.73 13.61 -8.46 -0.92 0
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307246 125292951 1 NS3O10C12H23 AB3C10D12E23 -386.06 5.85 -8.5 -1.37 0
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307247 125293024 1 SN3O7C40H43 AB3C7D40E43 -205.15 9.41 -8.88 -0.92 0
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307248 125293025 1 SN3O7C40H43 AB3C7D40E43 -204.56 11.47 -8.78 -1.28 0
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307249 125293029 1 O2N7C14H19 A2B7C14D19 7.83 7.37 -8.55 -1.3 0
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307252 125299286 4 O2C6H9 A2B6C9 -386.81 7.11 -9.68 0.31 0
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307253 125299287 1 FNO3C24H28 ABC3D24E28 -148.52 1.92 -9.82 -0.84 0
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307254 125299288 1 FNO3C24H28 ABC3D24E28 -149.12 3.04 -9.53 -0.84 0
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307255 125299289 1 FNO3C24H28 ABC3D24E28 -150.1 3.11 -9.76 -0.83 0
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307256 125299290 1 FNO3C24H28 ABC3D24E28 -147.36 4.24 -9.68 -0.82 0
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307259 125299297 1 N3O6H23C28 A3B6C23D28 -102.32 7.31 -9.14 -1.25 0
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307260 125299298 1 N3O6H23C28 A3B6C23D28 -103.84 7.44 -9.19 -1.37 0
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307261 125299299 1 N3O6H23C28 A3B6C23D28 -102.02 7.57 -9.18 -1.3 0
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307262 125299300 1 N3O6H23C28 A3B6C23D28 -103.85 7.38 -9.19 -1.36 0
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307263 125299301 1 IN2O5H11C14 AB2C5D11E14 -88.08 4.32 -9.87 -2.32 0
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307265 125299304 1 O3N4C14H16 A3B4C14D16 -16.25 3.22 -8.41 -1.57 0
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307267 125299308 2 ClNO2H8C11 ABC2D8E11 -27.76 2.15 -9.11 -1.21 0
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307268 125299309 1 PO5C14H21 AB5C14D21 -247.54 4.84 -9.44 0.25 0
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307269 125299310 1 SN6C12H14 AB6C12D14 164.51 5.26 -8.57 -1.63 0
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307270 125299311 1 SN6C12H14 AB6C12D14 166.94 7.47 -8.76 -1.42 0
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307271 125299315 1 OSN4H16C18 ABC4D16E18 107.57 4.97 -8.93 -1.69 0
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307272 125299318 1 N3P4C9O16H17 A3B4C9D16E17 -954.46 9.45 -9.98 -0.75 0
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307273 125299319 1 ClSN4O6C18H21 ABC4D6E18F21 -221.59 6.88 -8.64 -1.24 0
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307274 125299321 1 ClN3O3H18C19 AB3C3D18E19 -43.89 9.13 -8.59 -1.34 0
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307275 125299324 1 BrON5H12C13 ABC5D12E13 66.17 4.48 -9.15 -1.3 0
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307276 125299326 1 SO2F3N4C20H21 AB2C3D4E20F21 -161.7 5.55 -9.38 -2.15 0
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307277 125299327 1 N4C17H22 A4B17C22 51.93 5.83 -8.89 0.15 0
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307278 125299328 3 NOC7H7 ABC7D7 -1.18 7.89 -9.27 -1.2 0
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307279 125299329 3 NOC7H7 ABC7D7 0.94 9.07 -9.21 -1.02 0