REAL300009850735.mol2 47 1 C -0.12 -2.47 7.04 37.16 0.26 -2.21 16 2 C -0.12 -2.69 0.77 -156.81 -0.12 -2.81 16 3 C -0.11 -2.30 8.20 37.16 0.30 -1.99 16 4 C 0.51 15.80 6.58 36.01 0.24 16.04 16 5 O -0.68 -23.39 15.99 -20.23 -0.32 -23.72 16 6 O -0.69 -23.79 17.67 -20.23 -0.36 -24.14 16 7 C 0.01 0.24 4.39 -104.53 -0.46 -0.22 16 8 C -0.09 -1.75 7.90 -39.64 -0.31 -2.06 16 9 C -0.06 -1.11 9.63 -39.19 -0.38 -1.48 16 10 C -0.17 -2.49 5.24 -104.97 -0.55 -3.04 16 11 C 0.57 7.35 7.31 -12.33 -0.09 7.26 16 12 O -0.52 -8.56 16.17 5.32 0.09 -8.48 16 13 N -0.62 -4.65 2.24 -173.62 -0.39 -5.04 16 14 C 0.10 0.50 6.14 -2.94 -0.02 0.48 16 15 C -0.12 -0.28 5.71 -27.30 -0.16 -0.43 16 16 C -0.16 -0.93 4.61 -28.02 -0.13 -1.06 16 17 C 0.34 2.13 4.65 -29.78 -0.14 1.99 16 18 O -0.73 -13.01 17.84 -57.73 -1.03 -14.04 16 19 O -0.64 -11.26 16.84 -57.73 -0.97 -12.23 16 20 C -0.23 -1.38 4.08 -28.55 -0.12 -1.49 16 21 C 0.13 0.60 4.94 -4.06 -0.02 0.58 16 22 C -0.13 -1.83 7.29 -39.18 -0.29 -2.11 16 23 C -0.14 -2.30 8.96 -39.64 -0.36 -2.66 16 24 H 0.04 0.72 7.50 -51.92 -0.39 0.33 16 25 H 0.06 1.30 8.09 -51.93 -0.42 0.88 16 26 H 0.05 1.03 7.51 -51.93 -0.39 0.64 16 27 H 0.05 0.96 7.38 -51.93 -0.38 0.58 16 28 H 0.06 1.31 8.09 -51.93 -0.42 0.89 16 29 H 0.04 0.69 8.14 -51.93 -0.42 0.27 16 30 H 0.13 2.69 7.50 -52.48 -0.39 2.29 16 31 H 0.12 1.98 8.05 -52.49 -0.42 1.55 16 32 H 0.08 0.26 8.14 -51.93 -0.42 -0.16 16 33 H 0.10 0.75 6.90 -51.93 -0.36 0.39 16 34 H 0.08 -0.02 7.32 -51.93 -0.38 -0.40 16 35 H 0.11 0.11 8.14 -51.93 -0.42 -0.31 16 36 H 0.12 0.83 7.91 -51.93 -0.41 0.42 16 37 H 0.10 0.89 7.48 -51.93 -0.39 0.50 16 38 H 0.13 0.23 7.35 -51.93 -0.38 -0.15 16 39 H 0.30 3.77 9.01 45.56 0.41 4.18 16 40 H 0.34 5.80 9.20 45.56 0.42 6.22 16 41 H 0.13 1.17 6.31 -51.93 -0.33 0.85 16 42 H 0.13 0.63 8.14 -51.93 -0.42 0.21 16 43 H 0.10 0.06 8.06 -51.93 -0.42 -0.35 16 44 H 0.14 0.79 5.15 -51.93 -0.27 0.52 16 45 H 0.14 1.45 2.21 -52.50 -0.12 1.34 16 46 H 0.13 1.96 5.87 -52.48 -0.31 1.65 16 Total: -1.00 -48.19 359.62 -6.93 -55.12