REAL300018648554.mol2 45 1 O -0.69 -15.07 16.94 -20.23 -0.34 -15.41 16 2 C 0.50 9.07 6.76 36.00 0.24 9.32 16 3 O -0.68 -15.19 17.79 -20.23 -0.36 -15.55 16 4 C -0.16 -1.18 0.72 -155.18 -0.11 -1.29 16 5 C -0.09 -0.26 5.09 -25.84 -0.13 -0.39 16 6 C -0.15 1.05 4.93 -25.93 -0.13 0.92 16 7 C 0.10 -0.81 0.88 -90.47 -0.08 -0.89 16 8 C 0.01 -0.22 4.66 -3.83 -0.02 -0.23 16 9 N -0.51 10.83 1.70 -115.06 -0.20 10.63 16 10 H 0.43 -9.40 6.79 -39.29 -0.27 -9.67 16 11 H 0.44 -9.15 8.07 -39.29 -0.32 -9.47 16 12 C 0.05 -1.05 5.50 -4.98 -0.03 -1.08 16 13 C -0.16 2.88 5.36 -104.52 -0.56 2.32 16 14 C -0.05 0.83 9.68 -39.63 -0.38 0.45 16 15 C -0.11 1.13 9.75 -39.25 -0.38 0.74 16 16 C 0.32 -2.24 9.80 -38.73 -0.38 -2.62 16 17 O -0.64 -1.49 17.25 -57.73 -1.00 -2.48 16 18 O -0.64 -1.45 17.25 -57.73 -1.00 -2.45 16 19 C -0.11 1.10 9.75 -39.25 -0.38 0.71 16 20 C -0.05 0.78 9.68 -39.63 -0.38 0.39 16 21 C -0.13 0.58 5.22 -26.54 -0.14 0.44 16 22 C -0.10 -0.40 5.00 -26.45 -0.13 -0.53 16 23 O -0.40 1.77 9.70 -35.23 -0.34 1.43 16 24 C 0.10 0.38 5.31 37.30 0.20 0.58 16 25 H 0.08 0.41 8.14 -51.93 -0.42 -0.01 16 26 H 0.07 0.30 8.14 -51.93 -0.42 -0.13 16 27 H 0.06 -0.61 6.64 -51.93 -0.34 -0.95 16 28 H 0.08 -0.74 8.14 -51.93 -0.42 -1.17 16 29 H 0.14 -2.63 8.14 -51.93 -0.42 -3.05 16 30 H 0.14 -2.90 8.14 -51.93 -0.42 -3.32 16 31 H 0.15 -3.49 8.08 -51.93 -0.42 -3.91 16 32 H 0.15 -3.55 8.08 -51.93 -0.42 -3.97 16 33 H 0.17 -3.26 8.06 -52.49 -0.42 -3.69 16 34 H 0.18 -1.67 7.77 -52.49 -0.41 -2.08 16 35 H 0.35 0.07 8.90 45.56 0.41 0.48 16 36 H 0.35 0.06 8.90 45.56 0.41 0.47 16 37 H 0.18 -1.62 7.77 -52.49 -0.41 -2.03 16 38 H 0.17 -3.16 8.06 -52.49 -0.42 -3.59 16 39 H 0.08 -0.50 8.14 -51.93 -0.42 -0.92 16 40 H 0.08 -0.40 8.14 -51.93 -0.42 -0.82 16 41 H 0.07 0.42 8.14 -51.92 -0.42 -0.01 16 42 H 0.08 0.48 8.14 -51.93 -0.42 0.06 16 43 H 0.08 0.52 8.11 -51.93 -0.42 0.09 16 44 H 0.08 0.42 8.12 -51.93 -0.42 0.00 16 Total: 0.00 -49.38 355.38 -7.94 -57.32