REAL300018526581.mol2 45 1 C -0.15 -0.73 8.89 37.16 0.33 -0.40 16 2 C 0.13 0.46 0.82 -88.57 -0.07 0.39 16 3 C -0.14 -0.56 8.99 37.16 0.33 -0.22 16 4 O -0.37 1.13 11.21 -35.23 -0.39 0.73 16 5 C 0.01 -0.05 2.12 -96.73 -0.20 -0.26 16 6 C 0.04 -0.73 5.67 -3.83 -0.02 -0.75 16 7 N -0.51 10.62 1.74 -115.06 -0.20 10.42 16 8 H 0.43 -9.32 8.66 -39.30 -0.34 -9.66 16 9 H 0.44 -9.13 8.45 -39.29 -0.33 -9.46 16 10 C 0.05 -1.02 5.49 -4.97 -0.03 -1.05 16 11 C -0.16 2.83 5.36 -104.52 -0.56 2.27 16 12 C -0.05 0.80 9.68 -39.63 -0.38 0.41 16 13 C -0.11 1.10 9.75 -39.25 -0.38 0.72 16 14 C 0.33 -2.22 9.80 -38.72 -0.38 -2.60 16 15 O -0.64 -1.49 17.25 -57.73 -1.00 -2.49 16 16 O -0.64 -1.50 17.25 -57.73 -1.00 -2.49 16 17 C -0.11 1.10 9.75 -39.25 -0.38 0.72 16 18 C -0.05 0.79 9.68 -39.62 -0.38 0.40 16 19 C -0.14 0.19 7.40 -30.07 -0.22 -0.03 16 20 C -0.16 -0.98 1.20 -159.25 -0.19 -1.17 16 21 C 0.53 8.66 7.74 36.00 0.28 8.93 16 22 O -0.68 -13.98 17.96 -20.22 -0.36 -14.35 16 23 O -0.67 -13.50 15.11 -20.23 -0.31 -13.80 16 24 C -0.13 -0.07 7.17 -30.94 -0.22 -0.29 16 25 H 0.10 0.90 6.76 -51.93 -0.35 0.55 16 26 H 0.06 0.17 8.14 -51.93 -0.42 -0.25 16 27 H 0.05 0.21 6.58 -51.93 -0.34 -0.13 16 28 H 0.05 0.08 7.18 -51.93 -0.37 -0.29 16 29 H 0.06 0.12 8.14 -51.93 -0.42 -0.30 16 30 H 0.09 0.79 7.07 -51.93 -0.37 0.42 16 31 H 0.14 -2.50 8.14 -51.93 -0.42 -2.93 16 32 H 0.15 -2.73 8.14 -51.93 -0.42 -3.15 16 33 H 0.15 -3.46 8.08 -51.93 -0.42 -3.88 16 34 H 0.15 -3.50 8.08 -51.93 -0.42 -3.92 16 35 H 0.17 -3.20 8.06 -52.49 -0.42 -3.62 16 36 H 0.18 -1.63 7.77 -52.49 -0.41 -2.03 16 37 H 0.35 0.07 8.90 45.56 0.41 0.48 16 38 H 0.35 0.08 8.90 45.56 0.41 0.48 16 39 H 0.18 -1.63 7.77 -52.48 -0.41 -2.03 16 40 H 0.17 -3.16 8.06 -52.49 -0.42 -3.58 16 41 H 0.11 -0.18 7.83 -51.93 -0.41 -0.58 16 42 H 0.07 -0.18 7.24 -51.93 -0.38 -0.56 16 43 H 0.08 0.10 6.52 -51.93 -0.34 -0.24 16 44 H 0.10 0.03 7.83 -51.93 -0.41 -0.38 16 Total: 0.00 -47.18 362.35 -7.30 -54.48