REAL300018711573.mol2 47 1 C -0.14 -0.22 8.40 37.15 0.31 0.09 16 2 C -0.05 0.08 0.56 -150.23 -0.08 0.00 16 3 C -0.16 0.61 7.28 37.16 0.27 0.89 16 4 C -0.10 0.49 4.50 -85.20 -0.38 0.10 16 5 C -0.13 0.39 5.58 -23.27 -0.13 0.26 16 6 C -0.10 -0.01 5.36 -23.27 -0.12 -0.14 16 7 C -0.13 0.00 0.69 -150.39 -0.10 -0.10 16 8 C 0.50 4.02 5.75 36.01 0.21 4.22 16 9 O -0.68 -8.30 18.00 -20.23 -0.36 -8.67 16 10 O -0.66 -7.86 14.64 -20.23 -0.30 -8.16 16 11 C 0.03 -0.25 2.22 -65.32 -0.15 -0.39 16 12 N -0.51 5.39 1.42 -105.47 -0.15 5.24 16 13 H 0.44 -3.59 7.43 -39.29 -0.29 -3.88 16 14 H 0.42 -4.61 4.15 -39.29 -0.16 -4.77 16 15 C 0.04 -0.58 5.28 -4.97 -0.03 -0.61 16 16 C -0.15 1.79 5.36 -104.52 -0.56 1.23 16 17 C -0.05 0.61 9.68 -39.63 -0.38 0.22 16 18 C -0.11 0.71 9.75 -39.25 -0.38 0.33 16 19 C 0.33 -1.02 9.80 -38.72 -0.38 -1.40 16 20 O -0.65 -3.22 17.25 -57.73 -1.00 -4.21 16 21 O -0.64 -3.34 17.25 -57.73 -1.00 -4.34 16 22 C -0.10 0.62 9.75 -39.25 -0.38 0.23 16 23 C -0.05 0.47 9.68 -39.63 -0.38 0.09 16 24 C -0.13 1.23 4.74 -24.19 -0.11 1.11 16 25 H 0.08 0.47 6.79 -51.92 -0.35 0.11 16 26 H 0.05 0.01 8.08 -51.93 -0.42 -0.41 16 27 H 0.06 0.08 5.47 -51.93 -0.28 -0.20 16 28 H 0.04 -0.32 4.49 -51.93 -0.23 -0.56 16 29 H 0.08 -0.24 7.93 -51.93 -0.41 -0.65 16 30 H 0.08 -0.11 6.02 -51.93 -0.31 -0.42 16 31 H 0.11 -0.62 8.14 -51.93 -0.42 -1.04 16 32 H 0.07 -0.16 7.25 -51.93 -0.38 -0.53 16 33 H 0.07 -0.30 7.84 -51.93 -0.41 -0.71 16 34 H 0.07 -0.03 7.82 -51.93 -0.41 -0.44 16 35 H 0.08 0.24 7.60 -51.93 -0.39 -0.15 16 36 H 0.14 -1.18 7.73 -51.93 -0.40 -1.58 16 37 H 0.14 -2.41 6.91 -51.93 -0.36 -2.77 16 38 H 0.15 -2.31 8.04 -51.93 -0.42 -2.73 16 39 H 0.17 -2.45 8.06 -52.49 -0.42 -2.88 16 40 H 0.18 -1.10 7.77 -52.49 -0.41 -1.51 16 41 H 0.34 0.92 8.90 45.56 0.41 1.33 16 42 H 0.34 0.97 8.90 45.56 0.41 1.37 16 43 H 0.18 -0.91 7.77 -52.49 -0.41 -1.32 16 44 H 0.17 -2.11 8.06 -52.49 -0.42 -2.53 16 45 H 0.08 -0.94 6.02 -51.93 -0.31 -1.25 16 46 H 0.10 -0.99 7.84 -51.93 -0.41 -1.40 16 Total: 0.00 -30.07 347.97 -7.58 -37.64