REAL300025569601.mol2 30 1 O -0.59 -18.66 18.07 -19.17 -0.35 -19.01 15 2 C 0.48 13.90 9.62 53.44 0.51 14.41 15 3 N -0.63 -16.22 10.58 -14.53 -0.15 -16.37 15 4 C 0.16 3.59 8.01 -155.64 -1.25 2.35 15 5 C 0.22 3.13 6.84 -5.20 -0.04 3.09 15 6 N -1.09 -13.28 5.97 -11.66 -0.07 -13.35 15 7 S 2.70 25.42 5.74 -107.50 -0.62 24.80 15 8 O -0.94 -10.76 17.28 -57.17 -0.99 -11.75 15 9 O -0.94 -10.77 16.76 -57.17 -0.96 -11.73 15 10 C -0.67 -4.26 5.95 -39.58 -0.24 -4.49 15 11 C 0.03 0.17 9.52 -39.58 -0.38 -0.21 15 12 C -0.13 -0.80 8.62 -39.58 -0.34 -1.14 15 13 C 0.41 3.54 4.82 -39.59 -0.19 3.35 15 14 F -0.01 -0.09 16.66 2.25 0.04 -0.05 15 15 F -0.22 -3.16 15.31 2.25 0.03 -3.12 15 16 F -0.24 -3.37 15.31 2.25 0.03 -3.33 15 17 F -0.18 -2.57 15.32 2.25 0.03 -2.54 15 18 F -0.12 -1.56 15.31 2.25 0.03 -1.52 15 19 C -0.13 -0.84 8.62 -39.58 -0.34 -1.18 15 20 C 0.04 0.19 9.52 -39.58 -0.38 -0.18 15 21 N -0.47 -11.54 12.33 32.12 0.40 -11.14 15 22 O -0.06 -1.71 11.35 -7.38 -0.08 -1.79 15 23 H 0.10 1.16 7.75 -51.93 -0.40 0.75 15 24 H 0.08 0.83 8.14 -51.93 -0.42 0.41 15 25 H 0.44 6.02 7.92 -34.47 -0.27 5.74 15 26 H 0.19 0.51 7.62 -52.48 -0.40 0.11 15 27 H 0.19 0.90 7.40 -52.49 -0.39 0.51 15 28 H 0.19 0.99 7.40 -52.48 -0.39 0.60 15 29 H 0.19 0.57 7.62 -52.48 -0.40 0.17 15 Total: -1.00 -38.65 301.35 -3.41 -42.06