REAL300019835490.mol2 37 1 O -0.51 -9.93 16.00 5.35 0.09 -9.84 16 2 C 0.56 8.56 7.74 -12.21 -0.09 8.47 16 3 N -0.70 -10.61 4.96 -56.94 -0.28 -10.89 16 4 C 0.30 5.77 2.71 -70.23 -0.19 5.58 16 5 C 0.04 1.08 7.17 -155.99 -1.12 -0.04 16 6 N -0.37 -10.28 12.45 32.58 0.41 -9.88 16 7 N -0.20 -5.96 13.46 60.35 0.81 -5.15 16 8 N -0.19 -6.02 13.46 60.35 0.81 -5.20 16 9 N -0.37 -10.84 12.45 32.58 0.41 -10.44 16 10 C -0.07 -1.23 4.94 -104.62 -0.52 -1.74 16 11 C -0.10 -1.47 9.04 -39.58 -0.36 -1.83 16 12 C -0.12 -1.52 10.05 -39.58 -0.40 -1.92 16 13 C -0.12 -1.49 10.05 -39.58 -0.40 -1.89 16 14 C -0.12 -1.55 10.05 -39.59 -0.40 -1.94 16 15 C -0.10 -1.52 9.67 -39.59 -0.38 -1.90 16 16 C -0.11 -1.18 5.88 -104.89 -0.62 -1.80 16 17 C -0.04 -0.35 9.53 -39.23 -0.37 -0.72 16 18 C -0.11 -0.96 9.74 -39.30 -0.38 -1.35 16 19 C 0.34 3.74 9.79 -38.76 -0.38 3.36 16 20 O -0.67 -11.22 17.23 -57.73 -0.99 -12.22 16 21 O -0.67 -11.15 17.23 -57.73 -0.99 -12.14 16 22 C -0.11 -1.04 9.74 -39.30 -0.38 -1.42 16 23 C -0.02 -0.17 9.58 -39.23 -0.38 -0.55 16 24 H 0.40 4.68 4.91 -40.82 -0.20 4.48 16 25 H 0.11 2.10 7.43 -51.93 -0.39 1.72 16 26 H 0.12 1.67 6.93 -52.49 -0.36 1.31 16 27 H 0.12 1.21 8.06 -52.49 -0.42 0.78 16 28 H 0.12 1.10 8.06 -52.49 -0.42 0.67 16 29 H 0.12 1.23 8.06 -52.48 -0.42 0.81 16 30 H 0.13 1.78 8.04 -52.48 -0.42 1.36 16 31 H 0.17 0.92 6.39 -52.49 -0.34 0.58 16 32 H 0.18 1.38 7.75 -52.49 -0.41 0.97 16 33 H 0.33 4.57 8.90 45.56 0.41 4.97 16 34 H 0.33 4.55 8.90 45.56 0.41 4.95 16 35 H 0.18 1.50 7.75 -52.49 -0.41 1.10 16 36 H 0.18 1.56 7.64 -52.49 -0.40 1.16 16 Total: -1.00 -41.07 331.73 -4.50 -45.57