REAL300018555490.mol2 50 1 C -0.18 -0.09 8.31 37.16 0.31 0.22 16 2 C 0.11 0.37 1.12 -90.62 -0.10 0.27 16 3 C -0.14 -0.52 8.84 37.16 0.33 -0.19 16 4 C -0.18 -0.79 8.38 37.16 0.31 -0.48 16 5 O -0.33 -1.51 10.00 -35.23 -0.35 -1.87 16 6 C 0.09 -0.01 2.38 -25.83 -0.06 -0.07 16 7 H 0.10 -0.02 5.40 -51.93 -0.28 -0.30 16 8 C -0.16 0.97 7.26 -25.92 -0.19 0.78 16 9 C -0.02 0.16 3.25 -66.90 -0.22 -0.06 16 10 H 0.16 -1.98 8.04 -51.93 -0.42 -2.40 16 11 N -0.50 6.96 1.78 -107.12 -0.19 6.77 16 12 H 0.43 -7.03 8.71 -39.29 -0.34 -7.37 16 13 H 0.43 -5.48 8.21 -39.29 -0.32 -5.80 16 14 C 0.04 -0.58 5.16 -4.98 -0.03 -0.61 16 15 C -0.15 2.05 5.38 -104.29 -0.56 1.49 16 16 C -0.06 0.83 9.66 -39.63 -0.38 0.45 16 17 C -0.11 1.40 10.04 -39.48 -0.40 1.01 16 18 C -0.06 0.66 10.03 -39.63 -0.40 0.26 16 19 C -0.12 1.19 9.88 -39.25 -0.39 0.80 16 20 C 0.16 -1.56 8.81 -38.73 -0.34 -1.90 16 21 O -0.56 1.19 16.77 -57.73 -0.97 0.23 16 22 O -0.51 0.20 17.89 -57.73 -1.03 -0.84 16 23 C -0.08 0.09 2.77 -89.72 -0.25 -0.15 16 24 H 0.13 0.12 7.67 -51.93 -0.40 -0.28 16 25 C -0.18 -0.76 5.62 -27.88 -0.16 -0.92 16 26 C 0.49 7.49 8.05 36.01 0.29 7.78 16 27 O -0.65 -11.79 16.65 -20.23 -0.34 -12.13 16 28 O -0.67 -14.08 18.00 -20.22 -0.36 -14.44 16 29 H 0.06 0.04 8.14 -51.93 -0.42 -0.38 16 30 H 0.07 0.01 8.14 -51.93 -0.42 -0.42 16 31 H 0.05 -0.05 6.98 -51.93 -0.36 -0.42 16 32 H 0.07 0.42 8.14 -51.93 -0.42 -0.01 16 33 H 0.07 0.14 8.14 -51.93 -0.42 -0.28 16 34 H 0.06 0.20 8.14 -51.93 -0.42 -0.22 16 35 H 0.05 0.18 6.21 -51.93 -0.32 -0.14 16 36 H 0.06 0.18 8.14 -51.93 -0.42 -0.24 16 37 H 0.08 0.64 8.14 -51.93 -0.42 0.22 16 38 H 0.09 -0.69 8.14 -51.93 -0.42 -1.12 16 39 H 0.12 -0.51 7.92 -51.93 -0.41 -0.92 16 40 H 0.15 -2.10 4.84 -51.93 -0.25 -2.35 16 41 H 0.14 -2.64 7.93 -51.92 -0.41 -3.05 16 42 H 0.16 -2.62 8.00 -52.49 -0.42 -3.04 16 43 H 0.16 -2.10 8.06 -52.48 -0.42 -2.53 16 44 H 0.16 -2.08 8.06 -52.48 -0.42 -2.50 16 45 H 0.17 -1.71 8.06 -52.48 -0.42 -2.14 16 46 H 0.32 -2.16 6.81 45.56 0.31 -1.85 16 47 H 0.33 -1.70 8.83 45.56 0.40 -1.30 16 48 H 0.07 0.09 8.14 -51.93 -0.42 -0.34 16 49 H 0.07 0.25 7.85 -51.93 -0.41 -0.15 16 Total: 0.00 -38.76 396.89 -8.20 -46.96