REAL300020175944.mol2 34 1 O -0.52 -17.95 12.76 -3.98 -0.05 -18.00 16 2 C 0.56 18.44 7.61 86.74 0.66 19.10 16 3 N -0.65 -25.10 4.68 -305.68 -1.43 -26.53 16 4 C 0.14 5.42 6.31 38.42 0.24 5.66 16 5 C -0.12 -3.95 8.69 22.37 0.19 -3.76 16 6 C -0.09 -2.32 10.03 22.28 0.22 -2.09 16 7 C -0.12 -3.16 10.03 22.26 0.22 -2.94 16 8 C -0.09 -3.47 9.70 22.46 0.22 -3.25 16 9 C -0.03 -1.36 5.89 -19.93 -0.12 -1.48 16 10 C 0.09 5.11 7.88 137.40 1.08 6.19 16 11 N -0.39 -22.49 9.75 -52.27 -0.51 -23.00 16 12 N -0.20 -12.96 13.45 37.02 0.50 -12.46 16 13 N -0.21 -13.46 13.45 37.02 0.50 -12.97 16 14 N -0.39 -23.38 12.15 -52.27 -0.64 -24.02 16 15 C -0.14 -3.57 5.87 -20.08 -0.12 -3.69 16 16 C -0.06 -1.54 9.24 22.74 0.21 -1.33 16 17 C 0.24 5.63 9.79 22.82 0.22 5.85 16 18 O -0.62 -28.60 17.23 -127.47 -2.20 -30.80 16 19 O -0.71 -25.53 17.83 -127.47 -2.27 -27.80 16 20 C -0.03 -0.22 9.62 22.52 0.22 0.00 16 21 C -0.08 -0.36 10.00 22.25 0.22 -0.14 16 22 C 0.18 2.86 7.29 22.77 0.17 3.02 16 23 F -0.10 -1.79 15.54 44.97 0.70 -1.09 16 24 H 0.42 17.50 4.54 -92.71 -0.42 17.08 16 25 H 0.15 4.41 6.21 -2.91 -0.02 4.40 16 26 H 0.17 2.76 8.06 -2.91 -0.02 2.74 16 27 H 0.17 3.07 8.06 -2.91 -0.02 3.05 16 28 H 0.12 4.79 7.88 -2.91 -0.02 4.76 16 29 H 0.15 5.53 6.11 -2.91 -0.02 5.51 16 30 H 0.35 14.77 9.20 -74.06 -0.68 14.09 16 31 H 0.33 7.30 7.10 -74.06 -0.53 6.78 16 32 H 0.23 -0.18 6.47 -2.91 -0.02 -0.20 16 33 H 0.25 -1.63 8.06 -2.91 -0.02 -1.65 16 Total: -1.00 -95.42 306.48 -3.53 -98.95