REAL300007562067.mol2 34 1 O -0.68 -18.33 14.11 -20.23 -0.29 -18.62 16 2 C 0.48 12.67 6.73 36.00 0.24 12.91 16 3 O -0.68 -20.93 18.00 -20.23 -0.36 -21.30 16 4 C 0.07 1.53 3.31 -68.10 -0.23 1.30 16 5 C -0.10 -1.73 6.47 -24.89 -0.16 -1.89 16 6 C -0.13 -1.55 7.08 -24.58 -0.17 -1.73 16 7 C 0.12 1.57 7.10 -2.53 -0.02 1.55 16 8 N -0.98 -16.89 3.09 -105.63 -0.33 -17.22 16 9 S 2.72 45.45 5.62 -107.50 -0.60 44.84 16 10 O -0.94 -18.37 16.86 -57.17 -0.96 -19.34 16 11 O -0.96 -15.10 16.61 -57.17 -0.95 -16.05 16 12 C -0.66 -10.30 5.13 -39.58 -0.20 -10.50 16 13 C 0.03 0.37 9.52 -39.58 -0.38 0.00 16 14 C -0.14 -1.89 8.62 -39.59 -0.34 -2.23 16 15 C 0.42 6.87 4.82 -39.58 -0.19 6.68 16 16 F -0.04 -0.76 16.66 2.25 0.04 -0.72 16 17 F -0.16 -3.51 15.31 2.25 0.03 -3.48 16 18 F -0.13 -2.43 15.31 2.25 0.03 -2.40 16 19 F -0.23 -4.63 15.31 2.25 0.03 -4.59 16 20 F -0.23 -4.74 15.31 2.25 0.03 -4.71 16 21 C -0.13 -2.08 8.62 -39.59 -0.34 -2.42 16 22 C 0.10 1.66 7.06 -39.59 -0.28 1.38 16 23 H 0.08 1.61 8.14 -51.93 -0.42 1.19 16 24 H 0.08 1.13 8.14 -51.93 -0.42 0.71 16 25 H 0.08 1.36 7.84 -51.93 -0.41 0.95 16 26 H 0.07 0.80 8.14 -51.93 -0.42 0.38 16 27 H 0.08 0.78 8.14 -51.93 -0.42 0.36 16 28 H 0.08 0.88 7.78 -51.93 -0.40 0.48 16 29 H 0.07 0.88 8.14 -51.93 -0.42 0.45 16 30 H 0.18 1.57 7.62 -52.49 -0.40 1.17 16 31 H 0.18 1.92 7.40 -52.48 -0.39 1.53 16 32 H 0.18 2.81 7.40 -52.49 -0.39 2.42 16 33 H 0.18 3.29 7.59 -52.48 -0.40 2.89 16 Total: -1.00 -36.10 313.02 -5.17 -41.27