REAL300018569254.mol2 46 1 O -0.68 -15.45 17.72 -20.23 -0.36 -15.81 16 2 C 0.53 9.82 7.31 36.00 0.26 10.08 16 3 O -0.67 -14.75 15.93 -20.23 -0.32 -15.08 16 4 C -0.15 -1.39 1.59 -158.71 -0.25 -1.64 16 5 C -0.12 -0.47 7.02 -32.28 -0.23 -0.70 16 6 C 0.00 -0.01 2.15 -95.60 -0.21 -0.22 16 7 C 0.05 -0.57 5.68 -3.82 -0.02 -0.60 16 8 N -0.50 7.11 1.59 -115.05 -0.18 6.93 16 9 H 0.44 -5.39 7.05 -39.29 -0.28 -5.67 16 10 H 0.42 -6.86 8.44 -39.29 -0.33 -7.19 16 11 C 0.04 -0.68 4.64 -4.97 -0.02 -0.70 16 12 C -0.14 1.92 5.38 -104.29 -0.56 1.36 16 13 C -0.06 0.90 9.66 -39.63 -0.38 0.51 16 14 C -0.10 1.52 10.04 -39.49 -0.40 1.12 16 15 C -0.04 0.58 10.03 -39.63 -0.40 0.19 16 16 C -0.11 1.17 9.75 -39.25 -0.38 0.79 16 17 C 0.31 -3.13 9.76 -38.73 -0.38 -3.51 16 18 O -0.58 0.91 17.25 -57.73 -1.00 -0.08 16 19 O -0.73 4.48 12.36 -57.73 -0.71 3.77 16 20 C -0.13 -0.32 7.59 -31.43 -0.24 -0.56 16 21 O -0.35 0.02 11.60 -35.23 -0.41 -0.39 16 22 C 0.11 0.62 0.85 -90.80 -0.08 0.55 16 23 C -0.13 -0.88 7.65 -26.75 -0.20 -1.08 16 24 C -0.14 -0.67 8.09 -25.66 -0.21 -0.88 16 25 C -0.13 -0.86 7.58 -26.76 -0.20 -1.06 16 26 H 0.08 0.34 8.06 -51.93 -0.42 -0.08 16 27 H 0.10 0.38 7.78 -51.93 -0.40 -0.02 16 28 H 0.13 -1.82 8.14 -51.93 -0.42 -2.24 16 29 H 0.15 -1.68 8.14 -51.93 -0.42 -2.11 16 30 H 0.14 -2.65 8.00 -51.93 -0.42 -3.06 16 31 H 0.17 -2.20 5.77 -51.93 -0.30 -2.50 16 32 H 0.18 -3.20 8.03 -52.49 -0.42 -3.62 16 33 H 0.17 -2.68 8.06 -52.49 -0.42 -3.10 16 34 H 0.18 -2.61 8.06 -52.48 -0.42 -3.03 16 35 H 0.18 -1.77 7.77 -52.49 -0.41 -2.17 16 36 H 0.36 -1.20 8.90 45.56 0.41 -0.79 16 37 H 0.35 -1.87 8.90 45.56 0.41 -1.47 16 38 H 0.11 0.22 7.78 -51.93 -0.40 -0.18 16 39 H 0.07 0.14 8.14 -51.93 -0.42 -0.28 16 40 H 0.13 1.41 6.10 -51.93 -0.32 1.10 16 41 H 0.06 0.24 8.14 -51.93 -0.42 -0.18 16 42 H 0.07 0.19 8.14 -51.93 -0.42 -0.24 16 43 H 0.07 0.37 8.14 -51.93 -0.42 -0.05 16 44 H 0.07 0.32 8.14 -51.93 -0.42 -0.10 16 45 H 0.10 1.04 7.73 -51.92 -0.40 0.64 16 Total: 0.00 -39.40 364.69 -8.48 -47.87