REAL300018635271.mol2 47 1 O -0.70 -17.48 17.03 -20.23 -0.34 -17.82 16 2 C 0.49 10.40 7.55 36.01 0.27 10.67 16 3 O -0.70 -17.39 17.03 -20.22 -0.34 -17.74 16 4 C -0.16 -1.68 2.60 -91.80 -0.24 -1.92 16 5 C -0.09 -0.50 4.75 -26.67 -0.13 -0.63 16 6 C -0.10 0.31 5.03 -26.80 -0.13 0.18 16 7 C -0.06 0.44 0.76 -154.37 -0.12 0.32 16 8 C -0.14 1.72 6.59 -26.07 -0.17 1.55 16 9 C -0.01 0.21 3.35 -66.82 -0.22 -0.02 16 10 N -0.50 12.13 1.80 -107.05 -0.19 11.94 16 11 H 0.43 -10.88 8.26 -39.29 -0.32 -11.21 16 12 H 0.43 -11.06 8.69 -39.29 -0.34 -11.40 16 13 C 0.05 -1.12 5.46 -4.97 -0.03 -1.15 16 14 C -0.16 3.11 5.36 -104.52 -0.56 2.55 16 15 C -0.05 0.90 9.68 -39.63 -0.38 0.52 16 16 C -0.11 1.26 9.75 -39.25 -0.38 0.87 16 17 C 0.32 -2.66 9.80 -38.72 -0.38 -3.04 16 18 O -0.64 -0.77 17.25 -57.73 -1.00 -1.77 16 19 O -0.64 -0.76 17.25 -57.73 -1.00 -1.76 16 20 C -0.11 1.25 9.75 -39.25 -0.38 0.87 16 21 C -0.05 0.90 9.68 -39.63 -0.38 0.51 16 22 C -0.14 2.09 6.89 -26.08 -0.18 1.91 16 23 C -0.10 0.25 5.09 -26.79 -0.14 0.11 16 24 C -0.09 -0.55 4.75 -26.68 -0.13 -0.68 16 25 H 0.06 0.67 8.14 -51.93 -0.42 0.25 16 26 H 0.07 0.64 7.79 -51.93 -0.40 0.24 16 27 H 0.05 0.29 7.38 -51.93 -0.38 -0.09 16 28 H 0.07 -0.14 8.14 -51.93 -0.42 -0.57 16 29 H 0.06 -0.36 7.31 -51.93 -0.38 -0.74 16 30 H 0.11 -1.02 7.36 -51.93 -0.38 -1.40 16 31 H 0.10 -1.41 8.06 -51.93 -0.42 -1.83 16 32 H 0.16 -3.16 7.51 -51.93 -0.39 -3.55 16 33 H 0.15 -3.56 8.05 -51.93 -0.42 -3.98 16 34 H 0.15 -3.52 8.08 -51.93 -0.42 -3.94 16 35 H 0.17 -3.43 8.06 -52.49 -0.42 -3.85 16 36 H 0.18 -1.87 7.77 -52.48 -0.41 -2.28 16 37 H 0.35 -0.29 8.90 45.56 0.41 0.11 16 38 H 0.35 -0.29 8.90 45.56 0.41 0.11 16 39 H 0.18 -1.86 7.77 -52.48 -0.41 -2.27 16 40 H 0.17 -3.43 8.06 -52.49 -0.42 -3.85 16 41 H 0.10 -1.71 7.83 -51.93 -0.41 -2.11 16 42 H 0.10 -1.44 8.09 -51.93 -0.42 -1.86 16 43 H 0.06 -0.30 8.09 -51.93 -0.42 -0.72 16 44 H 0.07 -0.09 8.14 -51.93 -0.42 -0.52 16 45 H 0.07 0.68 7.79 -51.93 -0.40 0.27 16 46 H 0.05 0.32 7.97 -51.93 -0.41 -0.09 16 Total: 0.00 -55.20 369.35 -9.04 -64.24