REAL300020183346.mol2 38 1 O -0.52 -6.56 16.36 5.33 0.09 -6.47 16 2 C 0.56 5.22 7.31 -12.33 -0.09 5.13 16 3 C -0.10 -0.63 5.09 -104.97 -0.53 -1.17 16 4 C -0.04 -0.17 7.40 -39.18 -0.29 -0.46 16 5 C -0.11 -0.58 8.60 -39.64 -0.34 -0.92 16 6 C 0.38 2.98 4.83 -39.49 -0.19 2.79 16 7 F -0.01 -0.15 16.66 2.25 0.04 -0.11 16 8 F -0.23 -3.10 15.29 2.25 0.03 -3.07 16 9 F -0.23 -3.24 15.30 2.25 0.03 -3.21 16 10 F -0.18 -2.49 15.30 2.25 0.03 -2.46 16 11 F -0.12 -1.56 15.30 2.25 0.03 -1.52 16 12 C -0.11 -0.65 8.60 -39.64 -0.34 -0.99 16 13 C -0.02 -0.09 9.65 -39.18 -0.38 -0.47 16 14 N -0.59 -5.62 2.98 -174.17 -0.52 -6.14 16 15 C 0.09 0.77 4.92 -3.71 -0.02 0.75 16 16 C -0.12 -1.67 5.34 -26.61 -0.14 -1.81 16 17 C 0.03 0.55 2.62 -91.73 -0.24 0.31 16 18 C 0.06 1.42 6.87 -156.72 -1.08 0.34 16 19 N -0.39 -10.74 12.43 32.44 0.40 -10.34 16 20 N -0.20 -6.05 13.47 60.35 0.81 -5.24 16 21 N -0.20 -6.08 13.47 60.35 0.81 -5.26 16 22 N -0.39 -11.10 12.43 32.44 0.40 -10.69 16 23 C -0.12 -1.81 5.33 -26.85 -0.14 -1.96 16 24 C 0.11 1.23 6.41 -3.96 -0.03 1.21 16 25 H 0.18 0.28 6.69 -52.49 -0.35 -0.07 16 26 H 0.18 0.73 7.38 -52.49 -0.39 0.35 16 27 H 0.19 0.94 7.38 -52.48 -0.39 0.55 16 28 H 0.18 0.70 8.06 -52.49 -0.42 0.27 16 29 H 0.08 0.49 8.13 -51.93 -0.42 0.07 16 30 H 0.09 0.50 4.80 -51.93 -0.25 0.25 16 31 H 0.08 1.10 8.14 -51.93 -0.42 0.68 16 32 H 0.08 1.19 8.14 -51.93 -0.42 0.77 16 33 H 0.08 1.23 8.14 -51.93 -0.42 0.81 16 34 H 0.08 1.20 8.14 -51.93 -0.42 0.78 16 35 H 0.07 1.28 8.14 -51.93 -0.42 0.86 16 36 H 0.10 1.07 7.00 -51.93 -0.36 0.71 16 37 H 0.07 0.67 8.14 -51.93 -0.42 0.25 16 Total: -1.00 -38.72 330.22 -1.78 -40.50