REAL300018286297.mol2 36 1 O -0.69 -21.76 16.20 -20.23 -0.33 -22.09 16 2 C 0.48 14.67 7.20 36.00 0.26 14.93 16 3 O -0.67 -23.07 17.79 -20.23 -0.36 -23.43 16 4 C 0.06 1.38 2.46 -70.02 -0.17 1.21 16 5 N -0.64 -13.55 4.31 -110.47 -0.48 -14.03 16 6 C 0.10 1.94 4.54 -4.98 -0.02 1.92 16 7 C -0.06 -0.96 5.42 -104.29 -0.57 -1.53 16 8 C -0.07 -0.81 9.66 -39.63 -0.38 -1.19 16 9 C -0.11 -0.87 10.04 -39.48 -0.40 -1.26 16 10 C -0.09 -0.64 10.03 -39.63 -0.40 -1.04 16 11 C -0.12 -1.31 9.75 -39.25 -0.38 -1.69 16 12 C 0.33 5.10 9.76 -38.72 -0.38 4.72 16 13 O -0.57 -12.08 13.35 -57.73 -0.77 -12.85 16 14 O -0.74 -16.04 17.25 -57.73 -1.00 -17.04 16 15 C -0.03 -0.74 4.97 -104.56 -0.52 -1.26 16 16 C -0.11 -2.20 9.30 -39.52 -0.37 -2.57 16 17 C 0.08 1.44 7.30 -39.42 -0.29 1.15 16 18 F -0.14 -2.56 17.27 2.25 0.04 -2.52 16 19 C -0.14 -2.36 10.02 -39.52 -0.40 -2.76 16 20 C -0.13 -2.36 10.02 -39.52 -0.40 -2.75 16 21 C 0.10 2.27 7.16 -39.42 -0.28 1.99 16 22 F -0.13 -2.96 16.57 2.25 0.04 -2.92 16 23 H 0.09 2.29 7.45 -51.93 -0.39 1.90 16 24 H 0.34 7.46 7.17 -39.29 -0.28 7.17 16 25 H 0.11 2.20 5.69 -51.93 -0.30 1.90 16 26 H 0.06 1.22 7.48 -51.93 -0.39 0.83 16 27 H 0.17 1.73 8.03 -52.49 -0.42 1.31 16 28 H 0.15 0.66 8.06 -52.49 -0.42 0.24 16 29 H 0.16 0.59 8.06 -52.48 -0.42 0.17 16 30 H 0.17 1.85 7.77 -52.49 -0.41 1.44 16 31 H 0.32 6.17 8.90 45.56 0.41 6.58 16 32 H 0.32 6.18 8.90 45.56 0.41 6.58 16 33 H 0.14 2.88 6.89 -52.49 -0.36 2.52 16 34 H 0.14 1.76 8.06 -52.49 -0.42 1.34 16 35 H 0.14 1.97 8.06 -52.48 -0.42 1.55 16 Total: -1.00 -40.49 320.89 -6.13 -46.62