REAL300018711572.mol2 47 1 C -0.14 -0.46 8.11 37.16 0.30 -0.16 16 2 C -0.04 -0.08 0.69 -150.21 -0.10 -0.19 16 3 C -0.14 -0.55 8.47 37.16 0.31 -0.24 16 4 C -0.10 0.27 4.51 -85.31 -0.38 -0.12 16 5 C -0.13 0.40 5.55 -24.34 -0.13 0.26 16 6 C -0.12 -0.05 4.65 -24.34 -0.11 -0.17 16 7 C -0.13 -0.43 0.64 -150.37 -0.10 -0.53 16 8 C 0.51 6.63 7.30 36.01 0.26 6.90 16 9 O -0.68 -11.36 17.68 -20.23 -0.36 -11.72 16 10 O -0.66 -11.41 15.78 -20.23 -0.32 -11.73 16 11 C 0.04 -0.11 1.74 -65.32 -0.11 -0.22 16 12 N -0.49 3.23 1.00 -105.47 -0.11 3.13 16 13 H 0.44 -1.17 6.93 -39.29 -0.27 -1.44 16 14 H 0.41 -3.94 6.12 -39.29 -0.24 -4.18 16 15 C 0.04 -0.39 4.50 -4.97 -0.02 -0.41 16 16 C -0.14 1.23 5.37 -104.29 -0.56 0.67 16 17 C -0.06 0.74 9.66 -39.63 -0.38 0.35 16 18 C -0.11 1.24 10.04 -39.48 -0.40 0.84 16 19 C -0.05 0.50 10.03 -39.63 -0.40 0.10 16 20 C -0.11 0.75 9.76 -39.25 -0.38 0.37 16 21 C 0.30 -1.55 9.73 -38.72 -0.38 -1.93 16 22 O -0.69 -0.97 12.38 -57.73 -0.71 -1.69 16 23 O -0.59 -2.17 17.27 -57.73 -1.00 -3.17 16 24 C -0.13 0.80 4.53 -24.31 -0.11 0.69 16 25 H 0.05 0.09 8.14 -51.93 -0.42 -0.34 16 26 H 0.09 0.70 6.69 -51.93 -0.35 0.35 16 27 H 0.04 0.07 5.43 -51.93 -0.28 -0.21 16 28 H 0.06 0.20 5.44 -51.93 -0.28 -0.09 16 29 H 0.07 0.53 8.14 -51.93 -0.42 0.11 16 30 H 0.05 0.12 8.14 -51.93 -0.42 -0.30 16 31 H 0.11 -0.38 8.14 -51.93 -0.42 -0.80 16 32 H 0.08 -0.16 7.52 -51.93 -0.39 -0.55 16 33 H 0.06 -0.38 7.83 -51.93 -0.41 -0.78 16 34 H 0.04 -0.11 5.78 -51.92 -0.30 -0.41 16 35 H 0.09 0.34 7.30 -51.93 -0.38 -0.04 16 36 H 0.14 -0.17 7.23 -51.93 -0.38 -0.55 16 37 H 0.14 -1.77 6.75 -51.93 -0.35 -2.12 16 38 H 0.17 -1.04 5.78 -51.93 -0.30 -1.34 16 39 H 0.17 -2.54 8.01 -52.49 -0.42 -2.97 16 40 H 0.16 -2.20 8.06 -52.49 -0.42 -2.62 16 41 H 0.17 -2.07 8.06 -52.49 -0.42 -2.49 16 42 H 0.18 -1.08 7.79 -52.49 -0.41 -1.49 16 43 H 0.35 1.00 8.90 45.56 0.41 1.41 16 44 H 0.36 0.82 8.90 45.56 0.41 1.23 16 45 H 0.07 -0.74 6.83 -51.93 -0.35 -1.10 16 46 H 0.10 -0.61 7.53 -51.93 -0.39 -1.00 16 Total: 0.00 -28.27 344.86 -7.22 -35.49