REAL300013493710.mol2 38 1 O -0.68 -22.18 17.25 -20.54 -0.35 -22.53 16 2 C 0.52 14.83 7.98 34.52 0.28 15.10 16 3 O -0.67 -19.64 13.63 -20.54 -0.28 -19.92 16 4 C -0.12 -2.71 5.87 -105.00 -0.62 -3.33 16 5 C -0.09 -1.80 9.60 -39.14 -0.38 -2.18 16 6 C -0.13 -2.06 10.03 -39.64 -0.40 -2.46 16 7 C -0.13 -1.91 10.04 -39.47 -0.40 -2.31 16 8 C -0.12 -1.84 9.66 -39.64 -0.38 -2.22 16 9 C -0.09 -1.64 5.29 -104.19 -0.55 -2.19 16 10 C 0.18 3.34 4.82 -5.20 -0.03 3.32 16 11 N -0.69 -11.08 4.81 -66.42 -0.32 -11.40 16 12 C 0.71 10.61 8.41 -86.92 -0.73 9.88 16 13 O -0.57 -9.83 13.79 5.29 0.07 -9.75 16 14 N -0.68 -7.19 5.34 -14.22 -0.08 -7.26 16 15 C 0.24 2.28 6.29 -83.69 -0.53 1.75 16 16 C -0.10 -0.88 8.70 -39.40 -0.34 -1.22 16 17 C -0.04 -0.22 10.04 -39.61 -0.40 -0.62 16 18 C -0.13 -0.95 8.62 -39.55 -0.34 -1.29 16 19 C 0.39 3.99 4.82 -39.61 -0.19 3.80 16 20 F -0.15 -2.92 16.67 2.25 0.04 -2.89 16 21 F -0.16 -2.55 15.32 2.25 0.03 -2.52 16 22 F -0.17 -2.77 15.29 2.25 0.03 -2.73 16 23 F -0.17 -2.66 15.31 2.25 0.03 -2.63 16 24 F -0.16 -2.64 15.32 2.25 0.03 -2.61 16 25 C -0.16 -1.44 8.54 -39.39 -0.34 -1.78 16 26 H 0.13 2.65 7.65 -52.49 -0.40 2.24 16 27 H 0.12 1.48 8.06 -52.49 -0.42 1.05 16 28 H 0.11 1.29 8.06 -52.49 -0.42 0.87 16 29 H 0.12 1.47 8.03 -52.49 -0.42 1.05 16 30 H 0.05 0.88 8.00 -51.93 -0.42 0.47 16 31 H 0.12 2.64 5.94 -51.93 -0.31 2.33 16 32 H 0.40 5.74 8.48 -40.82 -0.35 5.40 16 33 H 0.42 3.31 8.84 -40.82 -0.36 2.94 16 34 H 0.19 1.94 6.24 -52.49 -0.33 1.61 16 35 H 0.18 0.34 8.06 -52.49 -0.42 -0.08 16 36 H 0.18 1.04 7.39 -52.49 -0.39 0.65 16 37 H 0.18 1.47 7.39 -52.49 -0.39 1.08 16 Total: -1.00 -39.62 343.55 -5.57 -45.18