REAL300013493733.mol2 35 1 O -0.71 -43.43 15.45 19.03 0.29 -43.14 16 2 C 0.51 29.55 6.98 71.24 0.50 30.05 16 3 O -0.73 -48.48 17.57 19.05 0.33 -48.15 16 4 C -0.23 -9.66 2.44 -52.93 -0.13 -9.79 16 5 C 0.20 6.89 5.81 86.38 0.50 7.39 16 6 N -0.73 -25.45 5.35 -478.54 -2.56 -28.01 16 7 C 0.71 20.23 8.41 179.05 1.51 21.73 16 8 O -0.59 -17.53 13.79 -3.98 -0.05 -17.59 16 9 N -0.67 -14.38 5.34 -317.17 -1.69 -16.08 16 10 C 0.23 3.83 6.29 38.15 0.24 4.07 16 11 C -0.10 -1.20 8.70 22.39 0.19 -1.01 16 12 C 0.00 -0.01 10.04 22.25 0.22 0.21 16 13 C -0.12 -1.08 8.62 22.29 0.19 -0.89 16 14 C 0.35 6.57 4.82 22.25 0.11 6.67 16 15 F -0.22 -9.07 16.65 44.97 0.75 -8.32 16 16 F -0.15 -4.39 15.31 44.97 0.69 -3.70 16 17 F -0.17 -5.83 15.29 44.97 0.69 -5.14 16 18 F -0.15 -4.58 15.30 44.97 0.69 -3.90 16 19 F -0.17 -5.64 15.32 44.97 0.69 -4.95 16 20 C -0.16 -2.76 8.54 22.39 0.19 -2.56 16 21 C -0.15 -5.01 9.88 30.60 0.30 -4.71 16 22 C -0.14 -4.91 9.77 30.60 0.30 -4.62 16 23 H 0.09 2.63 7.90 -2.39 -0.02 2.61 16 24 H 0.07 2.28 8.14 -2.39 -0.02 2.26 16 25 H 0.41 16.58 5.51 -92.71 -0.51 16.07 16 26 H 0.43 8.24 8.84 -92.71 -0.82 7.43 16 27 H 0.18 2.44 6.24 -2.91 -0.02 2.42 16 28 H 0.24 -1.37 8.06 -2.91 -0.02 -1.39 16 29 H 0.20 1.20 7.39 -2.91 -0.02 1.18 16 30 H 0.18 3.23 7.39 -2.91 -0.02 3.21 16 31 H 0.13 3.38 8.05 -2.39 -0.02 3.36 16 32 H 0.07 2.76 8.14 -2.39 -0.02 2.74 16 33 H 0.08 3.04 7.98 -2.39 -0.02 3.02 16 34 H 0.13 3.43 8.14 -2.39 -0.02 3.41 16 Total: -1.00 -88.51 317.46 2.42 -86.10