REAL300018693551.mol2 45 1 O -0.68 -14.72 16.70 -20.23 -0.34 -15.06 16 2 C 0.51 8.97 7.12 36.01 0.26 9.23 16 3 O -0.68 -14.78 17.96 -20.22 -0.36 -15.14 16 4 C -0.15 -1.04 1.05 -152.81 -0.16 -1.20 16 5 C 0.07 0.28 5.91 38.10 0.23 0.50 16 6 O -0.39 1.42 10.10 -35.23 -0.36 1.07 16 7 C 0.07 -0.50 1.13 -88.99 -0.10 -0.60 16 8 C 0.02 -0.25 5.04 -3.83 -0.02 -0.27 16 9 N -0.51 10.84 1.66 -115.06 -0.19 10.64 16 10 H 0.44 -9.27 8.43 -39.29 -0.33 -9.60 16 11 H 0.43 -9.60 6.70 -39.29 -0.26 -9.87 16 12 C 0.05 -1.01 5.50 -4.98 -0.03 -1.04 16 13 C -0.16 2.88 5.36 -104.53 -0.56 2.32 16 14 C -0.05 0.78 9.68 -39.63 -0.38 0.40 16 15 C -0.11 1.12 9.75 -39.25 -0.38 0.74 16 16 C 0.32 -2.35 9.80 -38.72 -0.38 -2.73 16 17 O -0.64 -1.23 17.25 -57.73 -1.00 -2.23 16 18 O -0.64 -1.29 17.25 -57.73 -1.00 -2.29 16 19 C -0.11 1.16 9.75 -39.25 -0.38 0.78 16 20 C -0.05 0.85 9.68 -39.63 -0.38 0.46 16 21 C -0.11 -0.03 5.27 -24.19 -0.13 -0.15 16 22 C -0.13 1.07 4.98 -26.28 -0.13 0.94 16 23 C -0.13 0.26 5.67 -24.29 -0.14 0.12 16 24 C -0.10 -0.44 5.23 -23.74 -0.12 -0.57 16 25 H 0.09 0.68 7.25 -51.92 -0.38 0.30 16 26 H 0.07 0.29 6.66 -51.93 -0.35 -0.06 16 27 H 0.15 -2.75 8.14 -51.93 -0.42 -3.17 16 28 H 0.14 -2.40 8.14 -51.93 -0.42 -2.83 16 29 H 0.15 -3.51 8.08 -51.93 -0.42 -3.93 16 30 H 0.15 -3.43 8.08 -51.93 -0.42 -3.85 16 31 H 0.17 -3.16 8.06 -52.49 -0.42 -3.59 16 32 H 0.18 -1.66 7.77 -52.49 -0.41 -2.07 16 33 H 0.35 -0.05 8.90 45.56 0.41 0.35 16 34 H 0.35 -0.03 8.90 45.56 0.41 0.37 16 35 H 0.18 -1.74 7.77 -52.49 -0.41 -2.14 16 36 H 0.17 -3.31 8.06 -52.49 -0.42 -3.73 16 37 H 0.09 -0.01 7.79 -51.93 -0.40 -0.42 16 38 H 0.08 0.10 8.14 -51.93 -0.42 -0.32 16 39 H 0.08 -0.73 8.02 -51.93 -0.42 -1.15 16 40 H 0.05 -0.66 6.40 -51.93 -0.33 -0.99 16 41 H 0.07 -0.18 8.14 -51.93 -0.42 -0.61 16 42 H 0.07 -0.10 6.02 -51.93 -0.31 -0.41 16 43 H 0.07 0.49 8.14 -51.93 -0.42 0.07 16 44 H 0.07 0.36 8.01 -51.93 -0.42 -0.05 16 Total: 0.00 -48.71 353.45 -7.73 -56.44