REAL300019727557.mol2 53 1 C -0.18 -2.47 8.37 37.16 0.31 -2.16 16 2 C 0.14 1.74 1.13 -90.62 -0.10 1.64 16 3 C -0.14 -1.32 8.85 37.16 0.33 -0.99 16 4 C -0.18 -2.18 8.37 37.16 0.31 -1.86 16 5 O -0.36 -5.35 9.94 -40.32 -0.40 -5.75 16 6 C 0.67 10.84 7.89 54.06 0.43 11.26 16 7 O -0.56 -10.19 11.54 -19.27 -0.22 -10.42 16 8 N -0.68 -9.29 4.40 -59.87 -0.26 -9.55 16 9 C 0.12 1.47 2.30 -69.08 -0.16 1.31 16 10 C 0.24 2.17 9.87 37.16 0.37 2.54 16 11 O -0.50 -7.70 13.44 -59.50 -0.80 -8.50 16 12 C 0.14 1.83 1.56 -89.98 -0.14 1.69 16 13 C -0.14 -1.55 7.78 37.16 0.29 -1.26 16 14 C -0.15 -1.63 7.77 37.16 0.29 -1.34 16 15 C 0.15 1.90 1.57 -89.98 -0.14 1.76 16 16 C -0.14 -1.54 7.78 37.16 0.29 -1.25 16 17 C -0.15 -1.55 7.79 37.16 0.29 -1.26 16 18 O -0.54 -8.55 14.24 -59.50 -0.85 -9.39 16 19 C 0.50 8.68 7.16 -10.99 -0.08 8.61 16 20 O -0.44 -9.76 15.08 5.55 0.08 -9.67 16 21 N -0.61 -11.09 5.30 -12.74 -0.07 -11.16 16 22 C 0.26 6.81 8.99 -320.41 -2.88 3.93 16 23 N -0.35 -10.42 10.72 30.09 0.32 -10.09 16 24 N -0.18 -5.56 13.46 60.35 0.81 -4.75 16 25 N -0.18 -5.28 13.46 60.35 0.81 -4.47 16 26 N -0.39 -10.83 12.45 30.09 0.37 -10.45 16 27 H 0.06 0.85 8.14 -51.93 -0.42 0.43 16 28 H 0.07 0.75 8.14 -51.93 -0.42 0.32 16 29 H 0.09 1.48 5.88 -51.93 -0.31 1.18 16 30 H 0.07 0.59 8.14 -51.93 -0.42 0.17 16 31 H 0.08 0.59 8.14 -51.93 -0.42 0.17 16 32 H 0.07 0.64 8.14 -51.93 -0.42 0.21 16 33 H 0.09 1.29 5.88 -51.93 -0.31 0.98 16 34 H 0.07 0.67 8.14 -51.93 -0.42 0.24 16 35 H 0.06 0.69 8.14 -51.92 -0.42 0.26 16 36 H 0.41 4.88 8.71 -40.82 -0.36 4.53 16 37 H 0.16 1.95 7.58 -51.93 -0.39 1.55 16 38 H 0.14 0.94 8.14 -51.93 -0.42 0.52 16 39 H 0.14 0.80 7.43 -51.92 -0.39 0.41 16 40 H 0.06 0.51 6.90 -51.93 -0.36 0.15 16 41 H 0.06 0.70 8.14 -51.93 -0.42 0.28 16 42 H 0.07 0.78 6.72 -51.93 -0.35 0.43 16 43 H 0.06 0.67 6.73 -51.93 -0.35 0.32 16 44 H 0.06 0.72 8.14 -51.93 -0.42 0.29 16 45 H 0.06 0.51 6.91 -51.93 -0.36 0.15 16 46 H 0.06 0.67 8.14 -51.93 -0.42 0.25 16 47 H 0.06 0.49 7.00 -51.93 -0.36 0.12 16 48 H 0.07 0.76 6.60 -51.93 -0.34 0.42 16 49 H 0.06 0.64 6.62 -51.93 -0.34 0.30 16 50 H 0.06 0.48 7.01 -51.93 -0.36 0.12 16 51 H 0.06 0.65 8.14 -51.93 -0.42 0.23 16 52 H 0.41 5.48 8.18 -40.82 -0.33 5.15 16 Total: -1.00 -41.65 417.08 -4.50 -46.14