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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387359 134985071 1 FSO3H15C20 ABC3D15E20 -76.71 2.66 -9.42 -0.96 0
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387360 134985074 1 N5O8C11H13 A5B8C11D13 10.18 6.56 -11.16 -2.91 0
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387361 134985075 2 O2N3C5H7 A2B3C5D7 44.33 6.88 -9.59 -0.93 0
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387362 134985085 2 NOC5H7 ABC5D7 17.32 0.66 -9.85 -0.74 0
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387363 134985088 1 NSC6O6F13 ABC6D6E13 -865.04 2.14 -11.7 -1.99 0
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387364 134985093 1 ClSN2O2C16H21 ABC2D2E16F21 -70.74 5.34 -8.6 -0.42 0
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387365 134985095 1 NSO2C21H23 ABC2D21E23 -17.78 5.29 -9.09 -0.44 0
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387366 134985107 1 SN2O2C14H20 AB2C2D14E20 -24.25 4.01 -9.3 -0.02 0
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387367 134985111 1 NSO4C14H17 ABC4D14E17 -72.89 5.89 -9.24 -0.83 0
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387368 134985112 1 SiN2O4C17H32 AB2C4D17E32 -179.5 5.55 -9.14 -0.49 0
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387369 134985118 1 ClNOC10H18 ABCD10E18 -33.22 2.95 -9.31 -0.96 0
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387370 134985119 1 NO3C11H13 AB3C11D13 -58.67 0.84 -9.25 -0.86 0
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387371 134985121 1 NO6C23H23 AB6C23D23 -127.41 6.74 -9.21 -1.2 0
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387372 134985123 2 ClNOH6C7 ABCD6E7 60.37 3.43 -9.12 -1.43 0
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387373 134985127 1 ClNPSO2C5H11 ABCDE2F5G11 -131.19 5.22 -9.49 -0.48 0
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387374 134985135 1 NO5C13H23 AB5C13D23 -177.14 2.84 -10.46 -0.55 0
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387375 134985139 1 N2O2H16C21 A2B2C16D21 111.17 4.86 -9.7 -0.99 0
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387376 134985140 1 N2O8C21H32 A2B8C21D32 -289.72 4.6 -9.94 -0.34 0
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387377 134985148 1 NO2C9H17 AB2C9D17 -32.85 4.87 -10.25 -0.51 0
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387378 134985158 1 NO7C20H29 AB7C20D29 -284.24 1.23 -9.66 -0.51 0
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387379 134985162 1 BrClC2F2N2 ABC2D2E2 -41.43 2.03 -10.91 -3.09 0
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387380 134985163 1 PC17H29 AB17C29 -24.45 1.56 -8.72 0.61 0
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387381 134985166 1 AlFeNPO2Cl4C18H32 ABCDE2F4G18H32 -304.75 11.58 0.0 0.0 0
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387384 134985186 2 ClN3C9H9 AB3C9D9 102.06 5.89 -8.66 -1.21 0
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387385 134985187 2 ClN3H11C12 AB3C11D12 133.26 8.75 -8.6 -1.06 0
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387386 134985195 1 NO6C39H45 AB6C39D45 -174.81 5.01 -9.22 0.01 0
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387387 134985196 1 NO6C39H45 AB6C39D45 -176.82 3.69 -9.24 0.04 0
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387388 134985199 1 N4O4C15H16 A4B4C15D16 -1.05 5.16 -9.57 -1.55 0
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387389 134985203 1 ClSO2N4C14H21 ABC2D4E14F21 -22.17 2.2 -9.81 -1.11 0
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387390 134985205 1 SN3O7C20H21 AB3C7D20E21 -163.14 1.45 -9.36 -0.62 0
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387391 134985208 2 NC9H14 AB9C14 -11.67 0.12 -8.52 0.57 0
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387392 134985209 2 NOC4H7 ABC4D7 -39.55 3.13 -9.51 0.3 0
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387393 134985214 1 O3N5C12H17 A3B5C12D17 7.64 5.73 -8.09 -0.87 0
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387395 134985223 1 N5C10O12H15 A5B10C12D15 -170.51 4.14 -11.19 -2.57 0
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387396 134985229 2 N2O2C5H7 A2B2C5D7 -64.84 4.16 -8.56 -0.53 0
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387399 134985233 2 NC6H7 AB6C7 64.43 4.86 -9.47 0.2 0
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387400 134985234 1 ClNOC19H28 ABCD19E28 -47.1 2.6 -8.8 0.38 0
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387401 134985240 1 SN2O2C18H20 AB2C2D18E20 16.63 3.42 -9.09 -0.27 0
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387402 134985241 1 NO2Cl4H17C19 AB2C4D17E19 -55.87 1.96 -9.7 -0.61 0
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387403 134985250 1 NOSC15H21 ABCD15E21 -7.99 0.68 -9.33 -0.11 0
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387404 134985252 1 NSO3C18H21 ABC3D18E21 -86.23 8.35 -9.65 -0.75 0
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387405 134985254 1 NSCl3O4C10H16 ABC3D4E10F16 -201.13 4.53 -9.88 -0.86 0
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387406 134985257 1 NO2C19H23 AB2C19D23 -40.99 3.09 -9.09 -0.66 0
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387407 134985261 1 O2C5N5H7 A2B5C5D7 42.5 2.54 -9.77 -1.38 0
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387408 134985271 1 ClNO4C27H28 ABC4D27E28 -51.58 7.25 -9.46 -0.4 0
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387409 134985282 1 ClNOC6H12 ABCD6E12 -20.32 2.93 -9.49 -1.2 0
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387410 134985284 1 FeNPO2C28H29 ABCD2E28F29 124.86 7.26 0.0 0.0 0
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387411 134985285 1 NO4C16H27 AB4C16D27 -128.7 3.06 -9.91 -0.46 0
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387412 134985286 1 NO2C12H25 AB2C12D25 -73.17 4.62 -10.98 -0.41 0
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387413 134985289 1 NO5C11H21 AB5C11D21 -158.12 6.51 -9.96 -0.69 0
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387414 134985290 1 N3O4H19C21 A3B4C19D21 -25.43 2.54 -8.6 -0.43 0
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387415 134985291 1 BrNC5O5H8 ABC5D5E8 -145.86 2.7 -11.34 -1.97 0
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387416 134985292 1 FNC3Cl3H3O3 ABC3D3E3F3 -120.59 3.77 -11.26 -1.41 0
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387417 134985297 1 SN2O2C12H16 AB2C2D12E16 -31.12 5.29 -9.42 -0.11 0
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387418 134985302 1 N2O8C25H30 A2B8C25D30 -290.89 1.27 -9.76 -0.69 0
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387419 134985307 1 FeNPO4C11H13 ABCD4E11F13 -83.21 1.6 0.0 0.0 0
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387420 134985308 1 FeNPC7H13 ABCD7E13 70.08 2.77 0.0 0.0 0
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387421 134985309 1 OsP2C27H45 AB2C27D45 -24.96 4.41 0.0 0.0 0
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387423 134985317 1 BPC12H19 ABC12D19 41.24 1.73 0.0 0.0 0
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387424 134985319 1 PN2C7H17 AB2C7D17 -27.23 2.01 -7.72 2.0 0
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387425 134985325 1 FN4O4C11H13 AB4C4D11E13 -77.52 2.4 -9.74 -1.76 0
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387426 134985326 1 N3C12H17 A3B12C17 56.39 3.9 -8.16 0.02 1
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387427 134985339 1 NPO9C32H35 ABC9D32E35 -336.18 10.88 0.0 0.0 0
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387428 134985344 1 Br2N2O2H10C13 A2B2C2D10E13 51.02 3.19 -9.9 -1.07 0
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387429 134985348 1 BrN2O2C10H13 AB2C2D10E13 19.57 1.36 -9.81 -1.0 0
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387430 134985351 1 N2O2H12C13 A2B2C12D13 46.28 5.05 -9.83 -0.64 0
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387431 134985352 1 N5C9O12H13 A5B9C12D13 -155.59 6.32 -11.16 -2.41 0
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387432 134985353 2 N2C6O6H9 A2B6C6D9 -283.67 3.84 -11.06 -1.61 0
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387433 134985355 2 BrPC9H12 ABC9D12 -35.99 2.36 -7.9 -0.55 0
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387434 134985356 2 PF3C12H13 AB3C12D13 -429.08 22.72 -8.87 -1.48 0
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387435 134985358 1 P2F6H26C27 A2B6C26D27 -398.95 24.11 -8.72 -1.42 1
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387436 134985361 1 PH26C27 AB26C27 82.17 13.56 0.0 0.0 0
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387437 134985364 1 BrNPC21H23 ABCD21E23 47.25 5.74 -8.47 -0.18 0
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387438 134985384 2 PF3C12H13 AB3C12D13 -434.12 17.63 -9.87 -0.9 0
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387439 134985388 1 ClNOC10H20 ABCD10E20 -69.84 4.34 -8.74 1.02 0