REAL300009850802.mol2 51 1 O -0.70 -25.70 18.00 -20.23 -0.36 -26.07 16 2 C 0.50 16.23 6.99 36.01 0.25 16.48 16 3 O -0.70 -24.58 17.29 -20.23 -0.35 -24.93 16 4 C -0.15 -3.81 2.58 -91.78 -0.24 -4.04 16 5 C -0.09 -1.85 5.19 -26.73 -0.14 -1.99 16 6 C -0.10 -1.55 4.98 -26.73 -0.13 -1.69 16 7 C -0.10 -1.47 1.66 -91.77 -0.15 -1.62 16 8 C 0.52 7.08 6.80 -10.99 -0.07 7.01 16 9 O -0.54 -9.20 15.50 5.56 0.09 -9.11 16 10 N -0.62 -5.70 2.95 -172.94 -0.51 -6.21 16 11 C 0.10 0.64 5.67 -3.89 -0.02 0.62 16 12 C -0.12 -0.51 5.24 -26.91 -0.14 -0.65 16 13 C -0.07 -0.23 0.76 -154.33 -0.12 -0.34 16 14 C -0.13 -0.39 6.78 -26.09 -0.18 -0.57 16 15 C -0.17 -0.37 3.39 -89.74 -0.30 -0.67 16 16 C 0.39 0.84 9.38 37.16 0.35 1.19 16 17 O -0.73 -10.72 17.78 -57.73 -1.03 -11.74 16 18 O -0.72 -9.85 16.65 -57.73 -0.96 -10.82 16 19 C -0.10 -0.05 6.42 -26.07 -0.17 -0.22 16 20 C -0.11 -0.59 5.20 -26.69 -0.14 -0.73 16 21 C 0.11 0.83 6.28 -3.67 -0.02 0.80 16 22 C -0.10 -1.69 4.73 -26.71 -0.13 -1.82 16 23 C -0.09 -1.99 4.93 -26.71 -0.13 -2.12 16 24 H 0.06 1.48 8.14 -51.93 -0.42 1.06 16 25 H 0.06 1.24 8.14 -51.92 -0.42 0.81 16 26 H 0.06 1.24 8.14 -51.93 -0.42 0.81 16 27 H 0.07 1.06 8.14 -51.93 -0.42 0.64 16 28 H 0.06 0.69 7.27 -51.93 -0.38 0.32 16 29 H 0.09 1.16 6.53 -51.92 -0.34 0.82 16 30 H 0.10 0.72 4.99 -51.93 -0.26 0.46 16 31 H 0.07 0.32 8.05 -51.93 -0.42 -0.10 16 32 H 0.08 0.18 8.12 -51.93 -0.42 -0.24 16 33 H 0.08 0.45 8.14 -51.93 -0.42 0.03 16 34 H 0.09 0.44 8.09 -51.93 -0.42 0.02 16 35 H 0.10 0.18 7.85 -51.93 -0.41 -0.23 16 36 H 0.15 0.63 6.95 -51.93 -0.36 0.27 16 37 H 0.14 -0.11 7.85 -51.93 -0.41 -0.52 16 38 H 0.14 -0.22 8.14 -51.93 -0.42 -0.64 16 39 H 0.33 4.24 8.90 45.56 0.41 4.65 16 40 H 0.33 4.08 8.90 45.56 0.41 4.49 16 41 H 0.10 -0.16 8.03 -51.93 -0.42 -0.58 16 42 H 0.10 0.04 7.32 -51.93 -0.38 -0.34 16 43 H 0.08 0.34 7.30 -51.93 -0.38 -0.03 16 44 H 0.08 0.53 8.14 -51.93 -0.42 0.11 16 45 H 0.06 0.37 7.41 -51.93 -0.38 -0.01 16 46 H 0.09 0.93 7.00 -51.93 -0.36 0.57 16 47 H 0.07 1.25 7.87 -51.93 -0.41 0.85 16 48 H 0.06 0.90 8.14 -51.93 -0.42 0.48 16 49 H 0.06 1.25 8.14 -51.93 -0.42 0.82 16 50 H 0.07 1.46 7.87 -51.93 -0.41 1.05 16 Total: -1.00 -49.90 384.75 -7.96 -57.86