REAL300019721267.mol2 46 1 C -0.14 -1.73 9.19 37.15 0.34 -1.39 16 2 C -0.10 -1.34 2.86 -90.62 -0.26 -1.60 16 3 C -0.15 -2.14 8.95 37.16 0.33 -1.81 16 4 C -0.11 -1.97 4.20 -26.73 -0.11 -2.08 16 5 C 0.26 5.61 2.38 -69.08 -0.16 5.45 16 6 N -0.71 -13.00 4.43 -54.93 -0.24 -13.24 16 7 C 0.52 9.71 7.79 -10.99 -0.09 9.63 16 8 O -0.54 -12.51 15.64 5.56 0.09 -12.43 16 9 C -0.13 -1.81 5.68 -27.88 -0.16 -1.97 16 10 C -0.07 -0.89 4.62 -27.88 -0.13 -1.02 16 11 C -0.07 -0.73 5.16 -104.37 -0.54 -1.27 16 12 C -0.08 -0.55 9.68 -39.59 -0.38 -0.93 16 13 C -0.10 -0.43 10.04 -39.47 -0.40 -0.83 16 14 C -0.11 -0.54 10.04 -39.60 -0.40 -0.93 16 15 C -0.08 -0.69 6.31 -104.36 -0.66 -1.35 16 16 C 0.26 2.99 9.97 -38.85 -0.39 2.61 16 17 O -0.53 -8.83 17.75 -56.57 -1.00 -9.84 16 18 O -0.47 -7.61 15.05 -56.57 -0.85 -8.46 16 19 C 0.09 0.99 7.74 35.92 0.28 1.27 16 20 C 0.05 1.32 7.16 -156.72 -1.12 0.20 16 21 N -0.38 -11.34 12.43 32.44 0.40 -10.94 16 22 N -0.20 -6.49 13.47 60.35 0.81 -5.67 16 23 N -0.20 -6.52 13.47 60.35 0.81 -5.71 16 24 N -0.38 -11.91 12.43 32.44 0.40 -11.51 16 25 H 0.05 0.64 8.14 -51.93 -0.42 0.22 16 26 H 0.05 0.55 8.14 -51.93 -0.42 0.13 16 27 H 0.05 0.61 8.14 -51.93 -0.42 0.19 16 28 H 0.07 0.95 7.62 -51.93 -0.40 0.56 16 29 H 0.05 0.63 8.14 -51.93 -0.42 0.21 16 30 H 0.05 0.77 8.14 -51.93 -0.42 0.35 16 31 H 0.06 0.98 6.46 -51.93 -0.34 0.64 16 32 H 0.07 1.23 8.14 -51.93 -0.42 0.81 16 33 H 0.08 1.43 8.14 -51.93 -0.42 1.01 16 34 H 0.10 2.21 5.78 -51.93 -0.30 1.91 16 35 H 0.40 6.06 8.60 -40.82 -0.35 5.71 16 36 H 0.10 1.22 8.14 -51.93 -0.42 0.80 16 37 H 0.09 1.09 8.14 -51.93 -0.42 0.67 16 38 H 0.10 1.23 8.01 -51.93 -0.42 0.82 16 39 H 0.10 1.56 7.30 -51.93 -0.38 1.18 16 40 H 0.16 0.82 8.06 -52.49 -0.42 0.40 16 41 H 0.15 0.23 8.06 -52.48 -0.42 -0.20 16 42 H 0.16 0.31 8.06 -52.48 -0.42 -0.11 16 43 H 0.35 4.84 9.30 45.56 0.42 5.26 16 44 H 0.07 0.59 8.14 -51.93 -0.42 0.16 16 45 H 0.07 0.58 8.14 -51.93 -0.42 0.16 16 Total: -1.00 -41.86 383.26 -5.32 -47.18