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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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60426 26685892 1 SN4O4C21H28 AB4C4D21E28 -135.46 5.34 -9.19 -0.16 0
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60427 26685893 1 SN4O4C21H28 AB4C4D21E28 -134.69 3.99 -9.19 -0.18 0
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60428 26685894 1 SN4O4C23H28 AB4C4D23E28 -111.58 6.43 -9.1 -0.68 0
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60429 26685895 1 SN4O4C23H28 AB4C4D23E28 -112.04 5.31 -9.14 -0.72 0
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60430 26685904 1 ClSN4O4C20H27 ABC4D4E20F27 -143.26 3.95 -8.84 -0.57 1
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60431 26686020 1 O2N3C24H34 A2B3C24D34 -31.18 5.19 0.0 0.0 0
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60432 26686021 1 O2N3C24H33 A2B3C24D33 -47.27 3.58 -8.29 0.08 1
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60433 26686022 1 N3O3C25H36 A3B3C25D36 -62.69 1.73 0.0 0.0 0
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60434 26686062 1 ON4C24H30 AB4C24D30 35.46 3.25 -8.28 -0.59 1
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60435 26686063 1 O2F3N4C24H30 A2B3C4D24E30 -168.23 2.42 0.0 0.0 0
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60436 26686064 1 O2F3N4C24H29 A2B3C4D24E29 -178.77 5.43 -8.72 -0.9 1
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60437 26686065 1 O2F3N4C24H30 A2B3C4D24E30 -163.14 9.22 0.0 0.0 0
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60438 26686066 1 O2F3N4C24H29 A2B3C4D24E29 -182.19 6.24 -8.71 -0.58 0
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60439 26686068 1 N3O3C24H31 A3B3C24D31 -74.59 4.25 -8.68 0.01 1
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60440 26686069 1 N3O3C24H32 A3B3C24D32 -60.23 2.75 0.0 0.0 0
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60441 26686071 1 SN2F3O5H21C23 AB2C3D5E21F23 -287.6 6.9 -8.52 -1.06 0
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60442 26686073 1 O2N3C23H31 A2B3C23D31 -43.93 2.02 -8.7 0.22 0
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60443 26686320 1 NO4C23H27 AB4C23D27 -143.59 6.37 -9.22 -0.71 0
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60444 26686368 1 NSO5C23H23 ABC5D23E23 -143.8 5.66 -8.63 -0.61 0
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60445 26686382 1 ClN2O4H19C23 AB2C4D19E23 -101.35 2.49 -8.99 -0.96 0
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60446 26686489 1 ClSN2O4C24H29 ABC2D4E24F29 -137.49 2.54 -8.7 -0.94 0
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60447 26686574 1 ClON3H22C23 ABC3D22E23 47.58 4.41 -8.84 -0.81 0
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60448 26686684 1 ClSN3O5H18C20 ABC3D5E18F20 -105.62 4.14 -9.67 -1.26 0
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60449 26686685 1 ClNSO7C21H22 ABCD7E21F22 -246.92 3.45 -9.2 -1.03 0
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60450 26686759 1 ClN3O5H16C25 AB3C5D16E25 -12.23 5.34 -8.9 -1.94 0
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60451 26686912 1 S2N3O4C17H19 A2B3C4D17E19 -96.29 3.88 -9.74 -1.36 0
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60452 26686990 1 SO2N5H15C19 AB2C5D15E19 51.79 3.74 -8.81 -1.73 0
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60453 26687012 1 SN3O4H15C21 AB3C4D15E21 -55.47 3.6 -9.48 -2.02 0
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60454 26687205 1 SN3O4C22H25 AB3C4D22E25 -85.26 6.65 -8.62 -1.04 0
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60455 26687247 1 N3O4C19H19 A3B4C19D19 -96.25 7.66 -8.44 -0.67 0
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60456 26687325 1 BrNF2O3H12C20 ABC2D3E12F20 -133.87 5.05 -8.69 -1.3 0
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60457 26688161 1 ClNOF4H8C14 ABCD4E8F14 -208.6 7.0 -9.44 -1.22 1
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60458 26697033 1 SN3O5C22H28 AB3C5D22E28 -107.74 3.19 0.0 0.0 0
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60459 26697034 1 SN3O5C22H27 AB3C5D22E27 -134.34 2.84 -8.69 -0.83 1
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60460 26697035 1 SN3O5C22H28 AB3C5D22E28 -112.14 1.83 0.0 0.0 0
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60461 26697040 1 FSN3O4C19H22 ABC3D4E19F22 -155.41 6.14 -8.86 -1.11 1
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60462 26697041 1 FN3O5C22H27 AB3C5D22E27 -182.91 6.69 0.0 0.0 1
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60463 26697042 1 N3O6C23H30 A3B6C23D30 -159.48 5.23 0.0 0.0 0
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60464 26697043 1 N3O6C23H29 A3B6C23D29 -184.44 4.78 -8.72 -0.34 1
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60465 26697044 1 N3O6C24H32 A3B6C24D32 -171.29 6.86 0.0 0.0 1
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60466 26697046 1 SN3O4C21H28 AB3C4D21E28 -98.78 6.29 0.0 0.0 1
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60467 26697047 1 N3O4C23H26 A3B4C23D26 -102.09 10.19 0.0 0.0 0
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60468 26697048 1 N3O4C23H25 A3B4C23D25 -109.61 3.11 -9.17 -1.66 1
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60469 26697049 1 FN3O4C21H25 AB3C4D21E25 -133.41 3.03 0.0 0.0 0
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60470 26697052 1 SF2N3O4C22H25 AB2C3D4E22F25 -213.6 7.52 -8.71 -1.17 0
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60471 26697054 1 SN3O6C20H29 AB3C6D20E29 -207.96 5.05 -8.95 -0.82 0
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60472 26697056 1 O3N4C22H24 A3B4C22D24 -44.68 2.46 -8.85 -1.02 0
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60473 26697058 1 N3O4C21H21 A3B4C21D21 -99.29 7.78 -8.67 -1.72 0
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60474 26697063 1 ClSN3O5C21H26 ABC3D5E21F26 -162.71 2.99 -8.37 -1.33 1
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60475 26697064 1 SN3O4C14H20 AB3C4D14E20 -43.36 4.66 0.0 0.0 -1
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60476 26697066 1 SCl2N3O5C20H22 AB2C3D5E20F22 -137.98 5.93 0.0 0.0 0
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60477 26697067 1 SCl2N3O5C20H23 AB2C3D5E20F23 -172.46 6.22 -8.87 -1.17 -1
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60478 26697068 1 BrSN3O4C20H23 ABC3D4E20F23 -81.9 1.78 0.0 0.0 0
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60479 26697069 1 BrSN3O4C20H24 ABC3D4E20F24 -120.83 7.27 -8.98 -1.04 -1
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60480 26697070 1 S2N3O4C17H20 A2B3C4D17E20 -62.02 4.97 0.0 0.0 0
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60481 26697072 1 SN4O6C19H28 AB4C6D19E28 -162.79 8.57 -9.12 -1.43 1
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60482 26697073 1 FSN3O4C19H23 ABC3D4E19F23 -129.0 3.62 0.0 0.0 1
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60483 26697074 1 SN3O3C22H28 AB3C3D22E28 -54.45 5.73 0.0 0.0 1
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60484 26697078 1 SN3O4C17H26 AB3C4D17E26 -117.66 2.97 0.0 0.0 1
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60485 26697079 1 SN3O4C21H28 AB3C4D21E28 -108.08 9.06 0.0 0.0 0
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60486 26697081 1 SF2N3O4C19H21 AB2C3D4E19F21 -201.76 5.46 -8.8 -1.5 1
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60487 26697084 1 SN3O4C20H26 AB3C4D20E26 -92.76 5.68 0.0 0.0 1
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60488 26697085 1 SN3O5C18H28 AB3C5D18E28 -163.84 2.82 0.0 0.0 1
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60489 26697087 1 SN3O5C23H30 AB3C5D23E30 -144.95 5.78 0.0 0.0 0
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60490 26697088 1 SN3O5C23H29 AB3C5D23E29 -158.75 7.22 -7.92 -0.81 1
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60491 26697089 1 SO2N4C23H27 AB2C4D23E27 48.35 7.67 0.0 0.0 0
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60492 26697090 1 SO2N4C23H26 AB2C4D23E26 25.56 6.6 -8.7 -0.58 1
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60493 26697091 1 SN3O4C20H24 AB3C4D20E24 -36.81 10.24 0.0 0.0 0
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60494 26697092 1 SN3O4C20H23 AB3C4D20E23 -44.78 5.62 -8.94 -1.48 1
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60495 26697093 1 O3N4C16H21 A3B4C16D21 -70.45 3.89 0.0 0.0 0
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60496 26697094 1 O3N4C16H20 A3B4C16D20 -83.58 3.19 -8.97 -0.82 1
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60497 26697097 1 SN3O4C20H26 AB3C4D20E26 -95.37 1.37 0.0 0.0 0
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60498 26697098 1 SN3O4C20H25 AB3C4D20E25 -121.21 3.66 -8.81 -0.95 1
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60499 26697099 1 O2N4C24H27 A2B4C24D27 31.96 7.07 0.0 0.0 0
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60500 26697100 2 ON2C12H13 AB2C12D13 23.22 3.88 -8.84 -0.82 1