REAL300019710644.mol2 38 1 O -0.49 -5.90 12.76 5.29 0.07 -5.83 16 2 C 0.56 4.76 7.61 -12.40 -0.09 4.67 16 3 N -0.65 -5.09 5.29 -10.73 -0.06 -5.15 16 4 C 0.08 0.87 6.30 -83.65 -0.53 0.34 16 5 C -0.09 -1.00 9.96 -39.40 -0.39 -1.40 16 6 C -0.20 -2.68 9.03 -39.46 -0.36 -3.04 16 7 C 0.14 2.41 6.69 -39.22 -0.26 2.15 16 8 O -0.30 -6.40 10.12 -19.65 -0.20 -6.60 16 9 C 0.18 3.90 5.36 36.01 0.19 4.09 16 10 C 0.04 1.21 7.99 -156.71 -1.25 -0.04 16 11 N -0.37 -11.26 12.43 32.44 0.40 -10.85 16 12 N -0.19 -6.09 13.47 60.35 0.81 -5.27 16 13 N -0.19 -6.08 13.47 60.35 0.81 -5.27 16 14 N -0.37 -11.24 12.43 32.44 0.40 -10.83 16 15 C -0.14 -2.12 9.98 -39.46 -0.39 -2.51 16 16 C -0.07 -0.94 8.69 -39.41 -0.34 -1.29 16 17 C -0.13 -0.69 5.87 -104.96 -0.62 -1.31 16 18 C -0.05 -0.22 9.24 -38.85 -0.36 -0.58 16 19 C 0.29 1.56 9.79 -38.73 -0.38 1.18 16 20 O -0.65 -7.42 17.23 -57.73 -0.99 -8.41 16 21 O -0.65 -7.38 17.23 -57.73 -0.99 -8.37 16 22 C -0.05 -0.12 9.74 -39.19 -0.38 -0.51 16 23 C -0.12 -0.14 10.00 -39.62 -0.40 -0.54 16 24 C 0.18 0.78 7.29 -38.81 -0.28 0.50 16 25 F -0.09 -0.61 15.54 2.25 0.03 -0.57 16 26 H 0.41 1.87 6.86 -40.82 -0.28 1.59 16 27 H 0.13 1.01 8.06 -52.49 -0.42 0.58 16 28 H 0.14 1.71 6.29 -52.49 -0.33 1.38 16 29 H 0.07 1.35 7.66 -51.93 -0.40 0.95 16 30 H 0.07 1.36 7.66 -51.93 -0.40 0.96 16 31 H 0.14 1.98 8.06 -52.48 -0.42 1.56 16 32 H 0.14 1.80 6.22 -52.49 -0.33 1.47 16 33 H 0.18 0.62 6.11 -52.49 -0.32 0.30 16 34 H 0.34 3.03 8.90 45.56 0.41 3.43 16 35 H 0.34 2.96 8.90 45.56 0.41 3.37 16 36 H 0.19 0.25 7.76 -52.49 -0.41 -0.15 16 37 H 0.19 -0.36 8.06 -52.49 -0.42 -0.78 16 Total: -1.00 -42.33 344.05 -3.29 -45.61