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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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38353 8032113 1 ClO2N4C22H23 AB2C4D22E23 2.24 4.84 -9.02 -1.0 0
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38354 8032136 1 ON4C24H28 AB4C24D28 39.23 7.24 -8.6 -0.42 0
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38355 8032270 1 O2N3C20H21 A2B3C20D21 5.8 6.95 -8.93 -0.1 0
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38356 8032349 1 ClFO2N3H13C19 ABC2D3E13F19 -57.23 6.08 -9.54 -0.85 0
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38357 8032350 1 N3O3C22H25 A3B3C22D25 -73.52 3.31 -7.8 -1.36 0
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38358 8032440 1 SN3O4C21H23 AB3C4D21E23 -90.96 4.17 -9.08 -1.34 0
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38359 8032446 1 N3O4C24H25 A3B4C24D25 -91.86 5.91 -8.2 -0.89 0
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38360 8032458 1 O2N5C24H27 A2B5C24D27 -3.46 9.48 -8.98 -0.78 0
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38361 8032496 1 N4O4C23H26 A4B4C23D26 -117.31 2.89 -7.86 -1.41 0
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38362 8032646 1 BrSN6H11C15 ABC6D11E15 162.33 6.63 -9.18 -1.3 0
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38363 8032702 1 ClN3O4C14H14 AB3C4D14E14 -128.1 1.25 -9.5 -1.0 1
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38364 8032779 1 NO3C18H26 AB3C18D26 -100.97 3.51 0.0 0.0 0
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38365 8032780 1 NO3C18H25 AB3C18D25 -104.65 3.92 -8.63 0.05 1
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38366 8032832 1 N2O2C22H31 A2B2C22D31 -58.47 5.79 0.0 0.0 0
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38367 8032918 1 FN2C20H23 AB2C20D23 -4.46 1.67 -8.59 -0.08 0
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38368 8033179 1 NO2F3C4H6 AB2C3D4E6 -251.98 5.36 -10.97 0.09 -1
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38369 8033324 1 N2O5C19H21 A2B5C19D21 -161.04 8.8 0.0 0.0 0
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38370 8033670 1 ClN5H6C8 AB5C6D8 122.87 4.94 -9.38 -1.3 0
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38371 8033769 3 NC5H7 AB5C7 26.83 6.9 -8.38 0.43 0
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38372 8033892 1 O3N5H19C23 A3B5C19D23 56.81 7.66 -9.2 -1.03 0
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38373 8033980 1 SN3O4C16H17 AB3C4D16E17 38.58 2.76 -9.01 -1.07 0
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38374 8034016 1 O2N5C17H21 A2B5C17D21 9.13 5.08 -8.31 -1.12 0
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38375 8034039 1 NO2F3C21H30 AB2C3D21E30 -259.58 5.49 -8.85 -0.47 0
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38376 8034050 1 O2N6C17H22 A2B6C17D22 34.82 6.53 -8.64 -1.43 0
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38377 8034051 1 OS2N4H14C17 AB2C4D14E17 81.08 5.86 -9.05 -1.96 1
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38378 8034053 1 FO3N4C22H22 AB3C4D22E22 -40.59 5.84 0.0 0.0 0
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38379 8034215 1 SN3O3C23H29 AB3C3D23E29 -57.64 8.35 -8.41 -1.23 0
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38380 8034314 1 O2N4C21H30 A2B4C21D30 -50.59 3.3 -8.66 0.12 0
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38381 8034317 1 FN2O2H17C18 AB2C2D17E18 -47.46 3.2 -8.63 -0.61 0
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38382 8034342 1 SN3O4C18H23 AB3C4D18E23 -140.33 6.01 -8.64 -0.63 0
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38383 8034361 1 BrO3N4C17H21 AB3C4D17E21 -53.4 5.04 -9.34 -0.52 0
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38384 8034362 1 ClSN3O5C17H20 ABC3D5E17F20 -135.52 4.62 -9.26 -0.99 0
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38385 8034429 2 N2O2C9H11 A2B2C9D11 -156.94 6.22 -9.58 -0.56 0
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38386 8034458 1 ClO3N4H17C18 AB3C4D17E18 -89.62 7.37 -8.85 -0.78 1
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38387 8034459 1 NO4C22H24 AB4C22D24 -85.38 12.43 0.0 0.0 0
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38388 8034462 1 SO2N3H15C20 AB2C3D15E20 34.22 4.25 -8.45 -1.47 0
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38389 8034494 1 ClN2O4H19C20 AB2C4D19E20 -113.04 6.75 -9.3 -1.55 0
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38390 8034525 1 SN2O2C15H18 AB2C2D15E18 -43.99 5.35 -9.09 -1.11 0
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38391 8034548 1 NF3O5H18C20 AB3C5D18E20 -240.31 6.56 -8.78 -1.62 0
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38392 8034575 1 O2N3C16H21 A2B3C16D21 -39.49 2.05 -8.51 -0.7 0
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38393 8034633 1 N3O3C20H23 A3B3C20D23 -51.07 4.37 -9.79 -0.29 0
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38394 8034663 1 OSN3H17C19 ABC3D17E19 19.87 6.39 -8.55 -0.5 1
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38395 8034664 1 FO2N4C15H18 AB2C4D15E18 -73.97 13.81 0.0 0.0 0
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38396 8034691 1 ON6H18C19 AB6C18D19 86.54 10.63 -9.53 -1.25 0
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38397 8034692 2 OSN2C10H12 ABC2D10E12 -43.78 3.51 -8.6 -1.48 0
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38398 8034901 1 O2N5H19C22 A2B5C19D22 84.16 9.32 -8.11 -1.09 1
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38399 8034987 1 NO4C17H20 AB4C17D20 -112.94 14.23 0.0 0.0 0
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38400 8035064 1 N2O4C19H24 A2B4C19D24 -131.5 3.8 -8.69 -0.88 1
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38401 8035065 1 ClFN2C21H21 ABC2D21E21 37.78 2.0 0.0 0.0 0
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38402 8035066 1 ClFN2H20C21 ABC2D20E21 17.6 2.95 -9.2 -0.21 0
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38403 8035104 1 SN2O4H14C19 AB2C4D14E19 -66.93 4.36 -9.28 -1.23 0
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38404 8035162 2 NO3H6C8 AB3C6D8 -138.34 3.15 -8.97 -0.97 1
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38405 8035183 1 ON3C15H22 AB3C15D22 -8.72 6.92 0.0 0.0 0
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38406 8035270 1 SN2O5C21H22 AB2C5D21E22 -182.29 4.97 -9.14 -1.1 0
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38407 8035333 1 N3O4C22H25 A3B4C22D25 -91.41 5.12 -8.54 -1.41 0
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38408 8035334 1 SO2N3C18H21 AB2C3D18E21 -55.49 3.5 -8.31 -1.21 0
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38409 8035797 1 N3O3C16H23 A3B3C16D23 -106.34 1.61 -9.79 -0.29 0
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38410 8035879 1 N4O4C23H26 A4B4C23D26 -92.03 3.5 -8.98 -0.82 0
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38411 8035907 1 ON2C16H16 AB2C16D16 37.49 4.69 -9.59 -0.56 1
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38412 8036145 1 SN2O2C21H33 AB2C2D21E33 -63.63 6.56 0.0 0.0 0
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38413 8036146 1 SN2O2C21H32 AB2C2D21E32 -89.41 5.65 -8.77 -0.46 1
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38414 8036147 1 SN3O4C14H24 AB3C4D14E24 -122.46 8.4 0.0 0.0 1
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38415 8036149 1 SN3O4C10H16 AB3C4D10E16 -29.93 4.35 0.0 0.0 1
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38416 8036221 1 N2O3H15C19 A2B3C15D19 -31.92 4.04 0.0 0.0 0
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38417 8036336 1 OSN3C21H21 ABC3D21E21 47.23 1.34 -7.87 -0.16 0
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38418 8036337 1 FOSN2H15C17 ABCD2E15F17 -4.25 5.49 -8.44 -0.51 0
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38419 8036422 1 BrSN2H17C18 ABC2D17E18 83.92 4.22 -8.16 -0.97 0
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38420 8036659 1 OSF2N3C13H15 ABC2D3E13F15 -70.43 2.33 -8.97 -0.79 0
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38421 8036794 1 ClSN3O3C20H20 ABC3D3E20F20 -68.74 4.24 -8.5 -0.85 0
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38422 8036818 1 SN4O5C15H18 AB4C5D15E18 -90.65 9.01 -9.03 -1.07 0
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38423 8036822 1 SN4O5C15H18 AB4C5D15E18 -94.76 13.45 -9.26 -1.27 0
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38424 8036843 1 SCl2O2N3C15H17 AB2C2D3E15F17 -73.25 5.64 -9.1 -0.92 0
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38425 8038139 1 ON3C13H17 AB3C13D17 -3.12 3.87 -9.31 -0.65 0
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38426 8038232 1 N3O3H11C15 A3B3C11D15 6.73 4.54 -8.7 -1.73 0
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38427 8044105 1 N2O2C19H22 A2B2C19D22 -40.05 4.93 -9.02 -0.32 0
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38428 8049081 1 FON2C17H17 ABC2D17E17 3.75 3.87 -9.08 -0.4 0
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38429 8049826 1 ClO3N5C18H26 AB3C5D18E26 -84.81 7.36 -9.2 0.29 0
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38430 8050401 1 N2O5C23H30 A2B5C23D30 -154.65 5.21 -7.96 0.08 0
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38431 8050550 1 O2N3C21H33 A2B3C21D33 -81.01 3.15 -8.59 0.14 0
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38432 8050952 1 FSO2N3C17H24 ABC2D3E17F24 -133.7 5.06 -9.23 -0.5 1
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38433 8051978 1 N3C18H26 A3B18C26 45.74 5.98 0.0 0.0 0
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38434 8053132 1 NO5C19H23 AB5C19D23 -170.95 2.15 -8.2 -0.87 0
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38435 8055296 1 N3O3C19H29 A3B3C19D29 -100.98 7.7 -8.88 -0.12 0
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38436 8055499 1 SN2O4C19H32 AB2C4D19E32 -193.27 7.19 -8.15 -0.32 0
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38437 8059079 1 OSN4C19H28 ABC4D19E28 -16.58 6.51 -8.72 -0.64 0
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38438 8060880 1 FNSO3C12H12 ABCD3E12F12 -156.1 5.42 -9.53 -0.92 0
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38439 8061470 1 ON3C21H23 AB3C21D23 35.86 2.8 -9.31 -0.02 0
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38440 8062241 1 N2O3C22H30 A2B3C22D30 -127.46 6.78 -9.17 -0.47 0
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38441 8064006 1 SN2O2C20H28 AB2C2D20E28 -91.54 2.53 -9.11 -0.32 0
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38442 8066398 1 FON2C23H27 ABC2D23E27 -61.96 8.23 -8.44 -0.02 0
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38443 8066917 1 NO4C15H19 AB4C15D19 -160.21 4.48 -9.36 0.14 0
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38444 8068034 1 NSO4C16H25 ABC4D16E25 -167.23 7.15 -9.09 -0.4 0
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38445 8068448 1 N3O4C16H19 A3B4C16D19 -135.96 9.99 -9.07 -0.98 0
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38446 8068612 1 NO4C19H23 AB4C19D23 -144.54 5.6 -9.03 -1.29 0
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38447 8071739 1 ON3C15H21 AB3C15D21 -27.19 4.42 -8.6 -0.34 1
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38448 8072908 1 ClON6C18H22 ABC6D18E22 76.47 3.92 0.0 0.0 0
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38449 8077593 1 NO5C21H31 AB5C21D31 -206.29 5.0 -9.19 0.49 0
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38450 8083681 1 O2S2N5C18H23 A2B2C5D18E23 3.32 4.78 -8.74 -1.26 1
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38451 8085536 1 NCl2O2C14H20 AB2C2D14E20 -70.29 3.02 0.0 0.0 0
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38452 8085909 1 O3N5C22H33 A3B5C22D33 -110.87 6.54 -8.88 -1.23 0