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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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328185 126694690 1 N3O4C29H33 A3B4C29D33 -30.78 4.54 -8.69 -1.0 0
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328186 126694823 1 NOC9H19 ABC9D19 -80.95 3.74 -9.63 1.36 0
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328187 126694830 1 NO3C27H53 AB3C27D53 -214.63 3.95 -9.58 1.44 0
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328188 126695481 1 PSN5O5C30H34 ABC5D5E30F34 -98.57 7.91 -8.8 -0.9 0
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328189 126695487 1 N2S2H32C49 A2B2C32D49 209.79 1.52 -7.88 -0.8 0
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328190 126695586 1 NO2C16H17 AB2C16D17 -30.59 4.2 -7.77 -0.01 0
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328191 126696008 1 SO7N9C41H53 AB7C9D41E53 -207.72 6.73 -8.4 -1.13 0
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328192 126696262 1 SO2N4C24H30 AB2C4D24E30 -7.23 3.76 -8.75 -0.62 0
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328193 126696570 1 ON6H22C23 AB6C22D23 65.5 5.67 -8.32 -0.26 0
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328194 126697520 1 NO5C38H67 AB5C38D67 -318.73 3.35 -8.72 0.08 0
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328195 126697524 1 BrPO4C23H48 ABC4D23E48 -347.26 5.69 -10.38 0.09 0
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328196 126697533 1 O4N5C32H61 A4B5C32D61 -220.22 7.26 -8.68 0.32 0
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328197 126697536 1 BrFNO4H5C8 ABCD4E5F8 -110.4 5.59 -10.82 -2.07 0
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328198 126697537 1 BrON3C14H14 ABC3D14E14 -2.05 2.49 -8.79 -1.14 0
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328199 126697538 1 NO2C26H53 AB2C26D53 -203.05 3.78 -8.96 0.9 0
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328200 126697544 1 OC26H52 AB26C52 -152.72 2.25 -9.59 1.3 0
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328201 126697594 1 SN3C19H27 AB3C19D27 31.1 4.58 -8.52 -0.73 0
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328202 126697622 1 FO2N5C24H28 AB2C5D24E28 -65.42 3.57 -8.77 -1.03 0
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328203 126697624 1 FO2N5C24H28 AB2C5D24E28 -63.72 2.42 -8.84 -1.12 0
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328204 126697628 1 O7C8H8 A7B8C8 -255.94 0.43 -10.6 -1.54 0
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328205 126697635 1 SO2N3C11H11 AB2C3D11E11 -34.21 5.43 -8.55 -0.81 0
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328206 126697643 1 NO2C32H57 AB2C32D57 -176.59 3.24 -9.04 0.35 0
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328207 126697644 1 ClFNO3H15C18 ABCD3E15F18 -121.39 3.39 -9.2 -0.98 0
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328208 126697661 1 ClFNO3H23C26 ABCD3E23F26 -93.89 4.6 -9.07 -0.73 0
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328210 126697666 1 ClF3N3O3C21H23 AB3C3D3E21F23 -254.39 4.62 -8.85 -0.49 0
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328211 126697667 1 O5C8H10 A5B8C10 -165.11 7.01 -10.74 -0.28 0
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328212 126697670 1 O4C17H34 A4B17C34 -262.09 5.16 -10.73 0.83 0
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328213 126697678 1 BrN2O8C15H23 AB2C8D15E23 -352.03 8.56 -9.98 -0.95 0
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328214 126697686 1 BrNSO4H16C17 ABCD4E16F17 -121.47 2.48 -8.7 -1.08 0
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328215 126697687 1 ClO3H15C16 AB3C15D16 -70.67 3.79 -9.65 -0.97 0
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328216 126697695 1 ClNO4H26C27 ABC4D26E27 -86.41 6.18 -8.7 -0.47 0
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328217 126697697 1 BrNCl2O3H14C18 ABC2D3E14F18 -70.01 1.46 -9.06 -0.89 0
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328218 126697713 1 ClF3N3O3C21H21 AB3C3D3E21F21 -235.63 0.24 -8.82 -1.04 0
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328219 126699269 1 BrFN3O4C21H27 ABC3D4E21F27 -221.89 6.08 -9.65 -0.56 0
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328220 126699400 1 SO3C17H20 AB3C17D20 -105.54 2.84 -8.72 -0.41 0
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328221 126699472 1 SF5O7C17H19 AB5C7D17E19 -541.1 4.53 -10.75 -1.27 0
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328222 126699478 1 OC13H18 AB13C18 -19.09 1.47 -9.05 0.45 0
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328223 126699495 1 ClN2H15C16 AB2C15D16 76.37 0.53 -9.38 -0.57 0
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328224 126699941 3 ON2C7H8 AB2C7D8 -28.56 3.08 -8.29 -1.19 0
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328225 126699954 1 O3N6C24H26 A3B6C24D26 -17.37 9.03 -8.18 -0.67 0
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328226 126700100 1 NOC7H11 ABC7D11 -12.15 1.67 -8.64 0.31 0
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328227 126700115 1 SO4N7C23H23 AB4C7D23E23 19.06 4.3 -8.59 -1.5 0
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328228 126700131 1 SO5N6H26C30 AB5C6D26E30 -6.69 1.96 -8.26 -1.3 0
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328229 126700133 1 SO3N7H17C23 AB3C7D17E23 107.2 0.8 -8.38 -1.5 0
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328230 126700135 1 SO4N5H23C24 AB4C5D23E24 2.49 1.49 -8.29 -1.32 0
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328231 126700205 1 ClFON4H16C17 ABCD4E16F17 -18.73 6.3 -9.2 -1.31 0
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328232 126700319 1 NOC11H17 ABC11D17 -55.78 4.31 -8.49 0.04 0
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328233 126700320 1 SF3N4O5C42H47 AB3C4D5E42F47 -241.02 3.45 -7.92 -0.93 0
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328234 126700321 2 NC10H11 AB10C11 54.63 2.86 -8.0 0.36 0
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328235 126700323 2 NC10H11 AB10C11 52.04 2.88 -7.83 0.36 0
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328236 126700326 1 O2N7C27H31 A2B7C27D31 42.15 4.4 -7.78 -0.57 0
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328237 126700331 1 SF3N4O4H41C44 AB3C4D4E41F44 -152.04 1.75 -7.95 -0.48 0
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328238 126700336 1 SF3N4O5H35C36 AB3C4D5E35F36 -195.66 2.71 -7.96 -0.99 0
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328239 126700344 1 NOC10H23 ABC10D23 -87.83 2.66 -8.87 2.37 0
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328240 126700345 1 BrON2C12H13 ABC2D12E13 63.03 7.72 -8.62 -0.27 0
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328241 126700346 1 O10C27H48 A10B27C48 -405.59 0.44 -8.51 0.15 0
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328242 126700350 1 SN2O2C18H20 AB2C2D18E20 19.08 4.29 -8.36 -0.46 0
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328243 126700357 1 NSO4C16H25 ABC4D16E25 -196.63 4.79 -9.57 -0.73 0
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328244 126700363 1 O5C22H26 A5B22C26 -188.48 5.16 -9.62 -0.89 1
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328245 126700364 1 O6N8C43H57 A6B8C43D57 -127.27 35.96 0.0 0.0 1
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328246 126700365 1 N7O8C46H60 A7B8C46D60 -216.91 10.17 0.0 0.0 0
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328247 126700366 1 N3O3C23H27 A3B3C23D27 -49.24 6.0 -9.0 -0.48 0
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328248 126700370 2 NOC10H13 ABC10D13 -61.43 9.91 -8.3 -1.42 0
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328249 126700373 1 NF3O4C25H28 AB3C4D25E28 -324.3 3.36 -9.74 -0.85 0
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328250 126700374 1 ClO5H23C26 AB5C23D26 -147.88 0.76 -9.1 -1.24 0
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328251 126700384 1 Cl2O8N9C56H67 A2B8C9D56E67 -236.79 16.13 -7.92 -1.62 0
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328252 126700387 2 SN5O8C30H33 AB5C8D30E33 -457.26 9.33 -8.73 -2.38 0
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328253 126700390 1 O9N11C46H53 A9B11C46D53 -195.03 10.8 -7.95 -2.06 0
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328254 126700395 1 O3N5C7H15 A3B5C7D15 -90.62 4.34 -9.28 0.19 0
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328255 126700399 2 NOSC4H9 ABCD4E9 -104.7 4.85 -8.61 -0.83 0
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328256 126700411 1 N2O2C15H24 A2B2C15D24 -89.78 6.03 -8.0 0.42 0
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328257 126700418 1 O5N8C27H32 A5B8C27D32 -117.26 10.58 -8.8 -1.26 0
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328258 126700419 4 ON2C5H5 AB2C5D5 -53.13 10.42 -8.93 -1.17 0
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328259 126700425 1 N4O7C30H30 A4B7C30D30 -169.31 7.69 -9.12 -1.49 0
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328260 126700427 1 SN6O11C41H48 AB6C11D41E48 -363.15 9.13 -8.06 -1.94 0