REAL300018577693.mol2 47 1 O -0.68 -9.61 15.09 -20.23 -0.31 -9.91 16 2 C 0.48 6.14 7.77 36.01 0.28 6.42 16 3 O -0.67 -13.17 18.00 -20.23 -0.36 -13.54 16 4 C -0.21 -0.67 5.13 -27.88 -0.14 -0.82 16 5 C 0.06 -0.24 1.93 -67.71 -0.13 -0.37 16 6 H 0.15 -0.43 7.79 -51.93 -0.40 -0.84 16 7 C 0.03 -0.24 5.44 37.16 0.20 -0.04 16 8 O -0.38 2.06 9.02 -35.23 -0.32 1.74 16 9 C 0.11 -0.57 6.06 36.01 0.22 -0.35 16 10 C -0.10 0.29 5.51 -104.62 -0.58 -0.29 16 11 C -0.09 0.14 9.70 -39.58 -0.38 -0.24 16 12 C -0.12 0.15 10.05 -39.58 -0.40 -0.25 16 13 C -0.11 0.19 10.05 -39.58 -0.40 -0.21 16 14 C -0.12 0.32 10.05 -39.58 -0.40 -0.08 16 15 C -0.10 0.35 9.70 -39.58 -0.38 -0.03 16 16 N -0.49 3.26 1.58 -108.00 -0.17 3.08 16 17 H 0.44 -0.94 6.17 -39.29 -0.24 -1.19 16 18 H 0.42 -3.86 8.13 -39.29 -0.32 -4.18 16 19 C 0.03 -0.34 4.89 -4.97 -0.02 -0.36 16 20 C -0.15 1.29 5.37 -104.29 -0.56 0.73 16 21 C -0.06 0.68 9.66 -39.63 -0.38 0.29 16 22 C -0.12 1.14 10.04 -39.48 -0.40 0.74 16 23 C -0.06 0.54 10.03 -39.63 -0.40 0.14 16 24 C -0.12 0.79 9.86 -39.25 -0.39 0.40 16 25 C 0.15 -0.76 8.82 -38.73 -0.34 -1.10 16 26 O -0.44 -2.52 17.89 -57.73 -1.03 -3.55 16 27 O -0.51 -1.95 16.75 -57.73 -0.97 -2.91 16 28 H 0.09 0.21 7.78 -51.93 -0.40 -0.19 16 29 H 0.10 0.35 8.14 -51.93 -0.42 -0.07 16 30 H 0.07 -0.73 6.30 -51.93 -0.33 -1.05 16 31 H 0.09 -0.63 8.14 -51.93 -0.42 -1.05 16 32 H 0.06 -0.47 8.09 -51.93 -0.42 -0.89 16 33 H 0.07 -0.36 8.08 -51.93 -0.42 -0.78 16 34 H 0.13 -0.29 8.06 -52.49 -0.42 -0.71 16 35 H 0.13 -0.30 8.06 -52.49 -0.42 -0.72 16 36 H 0.13 -0.38 8.06 -52.49 -0.42 -0.81 16 37 H 0.12 -0.54 8.06 -52.48 -0.42 -0.96 16 38 H 0.12 -0.73 8.06 -52.49 -0.42 -1.16 16 39 H 0.14 -1.86 6.29 -51.93 -0.33 -2.18 16 40 H 0.15 -1.27 4.62 -51.93 -0.24 -1.51 16 41 H 0.16 -2.08 8.02 -52.48 -0.42 -2.50 16 42 H 0.15 -1.71 8.06 -52.49 -0.42 -2.14 16 43 H 0.16 -1.64 8.06 -52.49 -0.42 -2.07 16 44 H 0.16 -1.18 8.06 -52.49 -0.42 -1.60 16 45 H 0.33 0.02 8.81 45.56 0.40 0.43 16 46 H 0.31 -0.72 6.75 45.56 0.31 -0.41 16 Total: 0.00 -32.27 385.97 -8.99 -41.26