REAL300009850827.mol2 51 1 O -0.70 -25.28 16.88 -20.23 -0.34 -25.63 16 2 C 0.50 16.62 7.39 36.00 0.27 16.89 16 3 O -0.70 -25.91 17.83 -20.23 -0.36 -26.27 16 4 C -0.15 -3.81 2.60 -91.78 -0.24 -4.05 16 5 H 0.06 1.41 8.14 -51.92 -0.42 0.99 16 6 C -0.09 -1.98 4.49 -26.73 -0.12 -2.10 16 7 C -0.12 -1.78 5.92 -26.73 -0.16 -1.94 16 8 C -0.10 -1.45 4.97 -26.73 -0.13 -1.58 16 9 C -0.10 -1.66 1.66 -91.75 -0.15 -1.81 16 10 H 0.09 1.22 6.54 -51.93 -0.34 0.88 16 11 C 0.52 8.00 6.80 -10.99 -0.07 7.92 16 12 O -0.53 -10.36 15.50 5.55 0.09 -10.28 16 13 N -0.62 -6.33 2.94 -172.67 -0.51 -6.84 16 14 C 0.11 0.73 5.69 -3.66 -0.02 0.71 16 15 C -0.12 -0.65 5.20 -26.69 -0.14 -0.79 16 16 C -0.07 -0.27 0.76 -154.34 -0.12 -0.39 16 17 C -0.10 -0.07 6.42 -26.08 -0.17 -0.24 16 18 C -0.17 -0.40 2.96 -89.74 -0.27 -0.66 16 19 C 0.39 0.87 9.53 37.16 0.35 1.23 16 20 O -0.71 -9.67 16.53 -57.73 -0.95 -10.63 16 21 O -0.74 -11.01 17.78 -57.73 -1.03 -12.03 16 22 C -0.12 -0.46 6.78 -26.09 -0.18 -0.64 16 23 C -0.12 -0.64 5.25 -26.69 -0.14 -0.78 16 24 C 0.11 0.89 6.29 -3.67 -0.02 0.87 16 25 C -0.07 -1.64 3.92 -26.71 -0.10 -1.74 16 26 H 0.06 1.35 8.10 -51.92 -0.42 0.93 16 27 H 0.06 1.40 8.10 -51.92 -0.42 0.98 16 28 H 0.06 0.79 8.14 -51.93 -0.42 0.37 16 29 H 0.06 0.78 8.14 -51.93 -0.42 0.36 16 30 H 0.06 0.61 7.26 -51.93 -0.38 0.23 16 31 H 0.07 1.05 8.14 -51.92 -0.42 0.63 16 32 H 0.10 0.74 4.99 -51.93 -0.26 0.48 16 33 H 0.07 0.33 7.42 -51.93 -0.39 -0.05 16 34 H 0.08 0.60 8.14 -51.93 -0.42 0.18 16 35 H 0.08 0.36 7.31 -51.93 -0.38 -0.02 16 36 H 0.10 0.04 7.32 -51.93 -0.38 -0.34 16 37 H 0.10 -0.13 8.04 -51.93 -0.42 -0.55 16 38 H 0.14 0.62 7.19 -51.93 -0.37 0.25 16 39 H 0.14 -0.19 8.14 -51.93 -0.42 -0.61 16 40 H 0.14 -0.13 7.84 -51.93 -0.41 -0.53 16 41 H 0.33 4.11 8.90 45.56 0.41 4.52 16 42 H 0.33 4.32 8.90 45.56 0.41 4.72 16 43 H 0.09 0.23 7.85 -51.93 -0.41 -0.18 16 44 H 0.09 0.56 8.09 -51.93 -0.42 0.14 16 45 H 0.08 0.24 8.12 -51.93 -0.42 -0.18 16 46 H 0.08 0.58 8.14 -51.93 -0.42 0.16 16 47 H 0.09 1.00 7.00 -51.93 -0.36 0.64 16 48 H 0.06 0.38 8.06 -51.93 -0.42 -0.04 16 49 H 0.07 1.61 7.87 -51.93 -0.41 1.20 16 50 H 0.06 1.57 8.09 -51.93 -0.42 1.15 16 Total: -1.00 -50.82 384.09 -7.90 -58.71