REAL300018443956.mol2 46 1 O -0.70 -13.33 14.67 -20.23 -0.30 -13.63 16 2 C 0.52 9.45 6.84 36.00 0.25 9.70 16 3 O -0.68 -15.68 16.16 -20.23 -0.33 -16.00 16 4 C -0.15 -1.63 1.00 -154.85 -0.15 -1.78 16 5 C -0.07 -0.34 4.50 -26.74 -0.12 -0.46 16 6 C -0.13 0.03 4.79 -26.74 -0.13 -0.10 16 7 C -0.14 1.51 5.44 -26.73 -0.15 1.36 16 8 C -0.01 0.18 5.37 -3.82 -0.02 0.16 16 9 N -0.51 11.90 1.74 -115.06 -0.20 11.70 16 10 H 0.43 -10.75 8.66 -39.29 -0.34 -11.09 16 11 H 0.43 -10.58 8.66 -39.29 -0.34 -10.92 16 12 C 0.05 -1.03 5.50 -4.98 -0.03 -1.06 16 13 C -0.16 2.96 5.36 -104.52 -0.56 2.40 16 14 C -0.05 0.87 9.68 -39.63 -0.38 0.48 16 15 C -0.11 1.20 9.75 -39.25 -0.38 0.82 16 16 C 0.32 -2.47 9.80 -38.72 -0.38 -2.85 16 17 O -0.64 -1.11 17.25 -57.73 -1.00 -2.11 16 18 O -0.64 -1.07 17.25 -57.73 -1.00 -2.07 16 19 C -0.11 1.18 9.75 -39.25 -0.38 0.79 16 20 C -0.05 0.84 9.68 -39.63 -0.38 0.45 16 21 C -0.12 -1.09 7.06 -25.92 -0.18 -1.27 16 22 C -0.13 -1.38 7.64 -25.92 -0.20 -1.58 16 23 C -0.12 -1.25 7.22 -25.91 -0.19 -1.44 16 24 H 0.06 0.30 8.14 -51.93 -0.42 -0.12 16 25 H 0.04 0.08 7.94 -51.93 -0.41 -0.33 16 26 H 0.06 -0.01 8.14 -51.93 -0.42 -0.43 16 27 H 0.12 0.58 5.28 -51.93 -0.27 0.31 16 28 H 0.08 -0.88 8.14 -51.93 -0.42 -1.30 16 29 H 0.07 -0.90 8.14 -51.93 -0.42 -1.33 16 30 H 0.14 -2.28 8.14 -51.93 -0.42 -2.70 16 31 H 0.13 -2.37 8.14 -51.93 -0.42 -2.80 16 32 H 0.15 -3.42 8.08 -51.93 -0.42 -3.84 16 33 H 0.15 -3.45 8.08 -51.93 -0.42 -3.87 16 34 H 0.17 -3.34 8.06 -52.49 -0.42 -3.76 16 35 H 0.18 -1.78 7.77 -52.48 -0.41 -2.19 16 36 H 0.35 -0.12 8.90 45.56 0.41 0.28 16 37 H 0.35 -0.13 8.90 45.56 0.41 0.27 16 38 H 0.18 -1.74 7.77 -52.49 -0.41 -2.15 16 39 H 0.17 -3.27 8.06 -52.49 -0.42 -3.69 16 40 H 0.06 0.35 7.96 -51.93 -0.41 -0.06 16 41 H 0.06 0.66 8.10 -51.93 -0.42 0.24 16 42 H 0.10 1.33 7.03 -51.93 -0.37 0.96 16 43 H 0.05 0.39 8.14 -51.93 -0.42 -0.03 16 44 H 0.06 0.74 8.09 -51.93 -0.42 0.32 16 45 H 0.07 0.46 8.10 -51.93 -0.42 0.04 16 Total: 0.00 -50.39 368.89 -8.70 -59.09