REAL300018632690.mol2 49 1 C 0.10 0.29 11.47 59.85 0.69 0.97 16 2 N -0.37 -2.67 4.01 -68.16 -0.27 -2.95 16 3 C 0.09 0.66 11.40 -17.22 -0.20 0.46 16 4 C -0.24 -1.71 5.03 -105.05 -0.53 -2.24 16 5 C 0.19 1.06 4.01 -25.84 -0.10 0.95 16 6 O -0.37 0.29 11.30 -35.23 -0.40 -0.10 16 7 C 0.01 -0.02 2.12 -96.75 -0.20 -0.22 16 8 C 0.05 -0.58 5.67 -3.82 -0.02 -0.60 16 9 N -0.50 7.24 1.59 -115.05 -0.18 7.06 16 10 H 0.44 -5.53 7.05 -39.29 -0.28 -5.80 16 11 H 0.42 -7.01 8.45 -39.29 -0.33 -7.34 16 12 C 0.04 -0.68 4.64 -4.97 -0.02 -0.71 16 13 C -0.14 1.93 5.38 -104.29 -0.56 1.36 16 14 C -0.06 0.90 9.66 -39.63 -0.38 0.51 16 15 C -0.10 1.52 10.04 -39.49 -0.40 1.12 16 16 C -0.04 0.59 10.03 -39.63 -0.40 0.19 16 17 C -0.11 1.18 9.75 -39.25 -0.38 0.80 16 18 C 0.31 -3.15 9.76 -38.73 -0.38 -3.53 16 19 O -0.58 0.92 17.25 -57.73 -1.00 -0.07 16 20 O -0.73 4.54 12.36 -57.73 -0.71 3.82 16 21 C -0.13 -0.27 7.60 -30.08 -0.23 -0.50 16 22 C -0.16 -1.37 1.61 -159.27 -0.26 -1.63 16 23 C 0.53 9.92 7.53 36.01 0.27 10.19 16 24 O -0.69 -15.59 18.00 -20.22 -0.36 -15.95 16 25 O -0.67 -15.62 17.86 -20.22 -0.36 -15.98 16 26 C -0.13 -0.46 7.04 -30.95 -0.22 -0.68 16 27 C 0.07 0.45 10.21 -17.36 -0.18 0.27 16 28 N -0.30 -2.50 12.58 30.63 0.39 -2.11 16 29 H 0.08 0.23 8.14 -51.93 -0.42 -0.19 16 30 H 0.09 0.01 8.14 -51.93 -0.42 -0.41 16 31 H 0.09 0.13 8.14 -51.93 -0.42 -0.29 16 32 H 0.17 1.02 8.06 -52.49 -0.42 0.59 16 33 H 0.10 0.57 8.14 -51.93 -0.42 0.15 16 34 H 0.13 -1.86 8.14 -51.93 -0.42 -2.28 16 35 H 0.15 -1.70 8.14 -51.93 -0.42 -2.12 16 36 H 0.14 -2.66 8.00 -51.93 -0.42 -3.07 16 37 H 0.17 -2.21 5.77 -51.93 -0.30 -2.51 16 38 H 0.18 -3.20 8.03 -52.49 -0.42 -3.62 16 39 H 0.17 -2.67 8.06 -52.49 -0.42 -3.09 16 40 H 0.17 -2.60 8.06 -52.48 -0.42 -3.02 16 41 H 0.18 -1.76 7.77 -52.49 -0.41 -2.17 16 42 H 0.36 -1.20 8.90 45.56 0.41 -0.80 16 43 H 0.35 -1.89 8.90 45.56 0.41 -1.49 16 44 H 0.11 0.20 7.83 -51.93 -0.41 -0.21 16 45 H 0.07 0.11 8.14 -51.93 -0.42 -0.31 16 46 H 0.08 0.38 5.07 -51.93 -0.26 0.12 16 47 H 0.10 0.33 7.83 -51.93 -0.41 -0.07 16 48 H 0.18 0.54 6.98 -52.49 -0.37 0.17 16 Total: 0.00 -43.92 399.67 -7.39 -51.31