REAL300018345593.mol2 36 1 O -0.65 -22.25 18.00 -20.23 -0.36 -22.62 16 2 C 0.48 14.46 6.53 36.01 0.24 14.70 16 3 O -0.60 -18.93 12.74 -28.03 -0.36 -19.29 16 4 C 0.06 1.36 2.40 -70.02 -0.17 1.19 16 5 N -0.66 -14.08 4.89 -110.46 -0.54 -14.62 16 6 C 0.09 1.79 4.71 -4.97 -0.02 1.77 16 7 C -0.07 -1.07 5.42 -104.29 -0.57 -1.64 16 8 C -0.08 -0.90 9.66 -39.63 -0.38 -1.28 16 9 C -0.13 -1.12 10.04 -39.48 -0.40 -1.52 16 10 C -0.10 -0.92 10.03 -39.63 -0.40 -1.32 16 11 C -0.12 -1.64 9.75 -39.25 -0.38 -2.02 16 12 C 0.26 4.69 9.76 -38.72 -0.38 4.31 16 13 O -0.48 -12.46 9.29 -67.38 -0.63 -13.09 16 14 O -0.79 -20.66 17.25 -57.73 -1.00 -21.66 16 15 C -0.07 -1.63 5.08 -104.56 -0.53 -2.16 16 16 C -0.07 -1.33 9.33 -39.59 -0.37 -1.69 16 17 C -0.14 -2.20 10.04 -39.58 -0.40 -2.59 16 18 C -0.11 -1.63 10.04 -39.60 -0.40 -2.03 16 19 C -0.16 -2.79 10.03 -39.51 -0.40 -3.19 16 20 C 0.10 2.16 7.24 -39.42 -0.29 1.88 16 21 F -0.13 -3.04 16.66 2.25 0.04 -3.01 16 22 H 0.08 2.05 7.60 -51.93 -0.39 1.65 16 23 H 0.36 8.58 5.95 -39.29 -0.23 8.35 16 24 H 0.08 1.81 5.65 -51.93 -0.29 1.52 16 25 H 0.07 1.24 7.92 -51.93 -0.41 0.83 16 26 H 0.15 1.37 8.03 -52.48 -0.42 0.95 16 27 H 0.14 0.78 8.06 -52.49 -0.42 0.36 16 28 H 0.15 0.92 8.06 -52.49 -0.42 0.49 16 29 H 0.16 2.32 7.77 -52.49 -0.41 1.91 16 30 H 0.36 9.55 7.68 45.56 0.35 9.90 16 31 H 0.31 7.61 8.90 45.56 0.41 8.01 16 32 H 0.13 2.54 6.83 -52.49 -0.36 2.18 16 33 H 0.12 1.54 8.06 -52.49 -0.42 1.11 16 34 H 0.12 1.40 8.06 -52.49 -0.42 0.97 16 35 H 0.13 1.84 8.06 -52.48 -0.42 1.42 16 Total: -1.00 -38.67 305.53 -6.96 -45.62