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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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243344 99222697 1 O2S2N3C23H27 A2B2C3D23E27 -43.18 2.91 -9.18 -0.9 0
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243345 99222698 2 NO2C13H16 AB2C13D16 -107.5 3.12 -8.31 -0.23 0
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243346 99222699 2 NO2C13H16 AB2C13D16 -106.49 3.42 -8.57 -0.53 0
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243347 99222700 1 O2N5C22H27 A2B5C22D27 -14.08 6.17 -9.47 -0.73 0
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243348 99222701 1 O2N5C22H27 A2B5C22D27 -11.79 5.41 -9.21 -0.59 0
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243349 99222702 1 SN3O3C23H27 AB3C3D23E27 -107.96 4.36 -8.73 -0.58 0
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243350 99222703 1 SN3O3C23H27 AB3C3D23E27 -111.3 4.43 -8.51 -0.48 0
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243351 99222704 1 SN3O3C23H27 AB3C3D23E27 -106.93 2.74 -8.77 -0.59 0
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243352 99222705 1 SN3O3C23H27 AB3C3D23E27 -104.79 2.89 -8.74 -0.56 0
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243353 99222706 1 SN4O4C21H28 AB4C4D21E28 -110.87 4.46 -9.0 -0.18 0
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243354 99222707 1 SN4O4C21H28 AB4C4D21E28 -110.49 9.07 -8.93 -0.07 0
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243355 99222708 1 N2O4C25H32 A2B4C25D32 -153.79 5.69 -9.12 -0.3 0
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243356 99222709 1 N2O4C25H32 A2B4C25D32 -154.34 6.66 -8.93 -0.55 0
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243357 99222710 1 O2S2N4C23H28 A2B2C4D23E28 -44.17 5.42 -8.7 -0.9 0
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243358 99222711 1 O2S2N4C23H28 A2B2C4D23E28 -43.28 4.45 -8.85 -1.03 0
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243359 99222712 1 F2N2O3C23H26 A2B2C3D23E26 -194.02 2.32 -9.27 -0.9 0
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243360 99222713 1 F2N2O3C23H26 A2B2C3D23E26 -193.59 3.13 -9.32 -0.8 0
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243361 99222714 1 SN3O4C21H27 AB3C4D21E27 -146.17 8.18 -9.09 -0.33 0
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243362 99222715 1 SN3O4C21H27 AB3C4D21E27 -144.85 4.87 -9.2 -0.53 0
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243363 99222716 1 N2O3C22H28 A2B3C22D28 -106.54 4.32 -9.13 -0.17 0
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243364 99222717 1 N2O3C22H28 A2B3C22D28 -108.86 5.93 -8.66 -0.22 0
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243365 99222718 1 BrN2O2C21H25 AB2C2D21E25 -66.17 2.31 -9.28 -0.54 0
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243366 99222719 1 BrN2O2C21H25 AB2C2D21E25 -66.95 4.39 -9.32 -0.18 0
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243367 99222720 1 FSN3O4C26H28 ABC3D4E26F28 -159.63 4.37 -9.17 -1.1 0
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243368 99222721 1 FSN3O4C26H28 ABC3D4E26F28 -161.16 6.04 -9.11 -0.79 0
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243369 99222722 1 N2O3C22H28 A2B3C22D28 -110.87 2.54 -9.17 -0.19 0
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243370 99222723 1 N2O3C22H28 A2B3C22D28 -111.22 2.53 -9.11 -0.05 0
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243371 99222724 2 NO2C11H14 AB2C11D14 -136.01 4.61 -8.65 -0.23 0
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243372 99222725 2 NO2C11H14 AB2C11D14 -135.99 6.32 -8.58 -0.12 0
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243373 99222726 1 FN2O3C21H25 AB2C3D21E25 -140.92 4.69 -9.05 -0.73 0
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243374 99222727 1 FN2O3C21H25 AB2C3D21E25 -139.23 4.56 -9.14 -0.18 0
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243375 99222728 1 N3O3C26H37 A3B3C26D37 -156.92 5.2 -9.21 0.13 0
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243376 99222729 1 N3O3C26H37 A3B3C26D37 -163.06 4.67 -9.09 0.3 0
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243377 99222730 1 N2O3C22H28 A2B3C22D28 -109.12 1.6 -9.19 -0.1 0
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243378 99222731 1 N2O3C22H28 A2B3C22D28 -108.93 1.8 -9.18 -0.11 0
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243379 99222732 2 NO2C11H14 AB2C11D14 -135.41 1.12 -8.58 -0.16 0
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243380 99222733 2 NO2C11H14 AB2C11D14 -133.37 0.84 -8.66 -0.21 0
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243381 99222734 1 N2O3C23H28 A2B3C23D28 -88.36 2.33 -9.0 -0.54 0
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243382 99222735 1 N2O3C23H28 A2B3C23D28 -87.48 2.46 -9.06 -0.66 0
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243383 99222736 1 FN2O2C21H25 AB2C2D21E25 -114.62 2.76 -9.2 -0.56 0
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243384 99222737 1 FN2O2C21H25 AB2C2D21E25 -115.18 2.89 -9.24 -0.45 0
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243385 99222738 1 N2O4C23H24 A2B4C23D24 -121.58 7.08 -9.35 -1.2 0
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243386 99222739 1 N2O4C23H24 A2B4C23D24 -119.74 5.74 -9.15 -1.17 0
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243387 99222740 1 N3O4C22H25 A3B4C22D25 -49.66 2.47 -9.12 -1.56 0
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243388 99222741 1 N3O4C22H25 A3B4C22D25 -51.81 8.55 -9.44 -1.3 0
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243389 99222742 1 N2O2C25H28 A2B2C25D28 -51.95 3.21 -9.09 -0.84 0
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243390 99222743 1 N2O2C25H28 A2B2C25D28 -51.86 4.58 -8.71 -0.35 0
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243391 99222744 1 N2O2F3C21H23 A2B2C3D21E23 -221.64 2.26 -9.48 -1.16 0
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243392 99222745 1 N2O2F3C21H23 A2B2C3D21E23 -220.54 2.82 -9.45 -1.11 0
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243393 99222746 1 N2O3C21H26 A2B3C21D26 -102.22 0.98 -9.22 -0.12 0