REAL300019764245.mol2 38 1 O -0.55 -16.95 16.00 -3.78 -0.06 -17.01 16 2 C 0.56 12.95 7.74 86.86 0.67 13.62 16 3 N -0.69 -16.13 4.96 -452.36 -2.24 -18.37 16 4 C 0.31 9.58 2.71 43.50 0.12 9.69 16 5 C 0.05 2.46 7.16 138.33 0.99 3.45 16 6 N -0.38 -18.98 12.45 -50.85 -0.63 -19.61 16 7 N -0.22 -12.69 13.46 37.02 0.50 -12.19 16 8 N -0.22 -12.91 13.46 37.02 0.50 -12.42 16 9 N -0.39 -20.98 12.45 -50.85 -0.63 -21.61 16 10 C -0.06 -1.49 4.94 -19.87 -0.10 -1.59 16 11 C -0.10 -2.02 9.67 22.27 0.22 -1.80 16 12 C -0.07 -1.32 9.83 22.28 0.22 -1.10 16 13 C -0.08 -1.70 6.33 22.36 0.14 -1.56 16 14 Cl -0.05 -0.97 28.62 -2.72 -0.08 -1.05 16 15 C 0.10 2.39 7.28 22.39 0.16 2.55 16 16 F -0.13 -3.36 16.84 44.97 0.76 -2.60 16 17 C -0.13 -3.07 9.03 22.31 0.20 -2.87 16 18 C -0.12 -1.64 5.88 -20.04 -0.12 -1.75 16 19 C -0.01 -0.05 9.53 22.52 0.21 0.16 16 20 C -0.12 -1.66 10.08 22.40 0.23 -1.43 16 21 C 0.30 6.08 10.27 22.76 0.23 6.31 16 22 O -0.99 -52.70 18.54 -128.57 -2.38 -55.09 16 23 O -0.40 -11.12 15.05 -128.57 -1.94 -13.05 16 24 C 0.08 0.66 7.74 71.19 0.55 1.22 16 25 C -0.12 -1.22 6.30 -19.70 -0.12 -1.35 16 26 C 0.02 0.19 9.58 22.50 0.22 0.40 16 27 H 0.41 6.83 4.89 -92.71 -0.45 6.37 16 28 H 0.12 3.59 7.44 -2.39 -0.02 3.57 16 29 H 0.16 2.87 8.03 -2.91 -0.02 2.84 16 30 H 0.18 2.16 8.06 -2.91 -0.02 2.14 16 31 H 0.15 3.39 6.91 -2.91 -0.02 3.37 16 32 H 0.20 0.87 6.39 -2.91 -0.02 0.85 16 33 H 0.19 2.57 8.06 -2.91 -0.02 2.54 16 34 H 0.28 14.72 9.30 -74.06 -0.69 14.03 16 35 H 0.24 -0.47 8.14 -2.39 -0.02 -0.49 16 36 H 0.23 -0.08 8.14 -2.39 -0.02 -0.10 16 37 H 0.21 1.15 7.64 -2.91 -0.02 1.13 16 Total: -1.00 -109.05 358.88 -3.72 -112.77