REAL300019664113.mol2 34 1 O -0.54 -10.90 14.03 -3.83 -0.05 -10.96 16 2 C 0.56 6.04 7.51 86.85 0.65 6.69 16 3 N -0.64 -5.54 5.28 -305.84 -1.61 -7.15 16 4 C 0.14 2.86 6.27 38.24 0.24 3.10 16 5 C -0.12 -3.18 8.64 22.36 0.19 -2.99 16 6 C -0.09 -3.41 9.69 22.45 0.22 -3.19 16 7 C -0.01 -0.60 5.88 -20.02 -0.12 -0.72 16 8 C 0.09 5.07 7.93 137.41 1.09 6.16 16 9 N -0.39 -23.21 12.15 -52.24 -0.63 -23.84 16 10 N -0.21 -13.53 13.45 37.02 0.50 -13.04 16 11 N -0.21 -13.74 13.45 37.02 0.50 -13.24 16 12 N -0.40 -24.05 12.15 -52.24 -0.63 -24.69 16 13 C -0.09 -2.84 9.69 22.45 0.22 -2.63 16 14 C -0.12 -2.38 9.95 22.36 0.22 -2.16 16 15 C -0.11 -0.37 5.88 -20.04 -0.12 -0.49 16 16 C -0.01 0.01 9.53 22.50 0.21 0.23 16 17 C -0.10 -0.32 9.74 22.45 0.22 -0.10 16 18 C 0.35 4.01 9.79 22.80 0.22 4.23 16 19 O -0.74 -22.46 17.23 -127.47 -2.20 -24.66 16 20 O -0.73 -20.97 17.23 -127.47 -2.20 -23.16 16 21 C -0.11 -0.76 9.73 22.45 0.22 -0.54 16 22 C 0.00 0.01 9.58 22.50 0.22 0.22 16 23 H 0.43 -0.76 6.86 -92.71 -0.64 -1.40 16 24 H 0.14 3.61 6.42 -2.91 -0.02 3.59 16 25 H 0.11 4.54 7.88 -2.91 -0.02 4.52 16 26 H 0.13 4.34 7.88 -2.91 -0.02 4.32 16 27 H 0.18 1.83 8.06 -2.91 -0.02 1.80 16 28 H 0.22 -2.52 6.41 -2.91 -0.02 -2.54 16 29 H 0.20 0.47 7.75 -2.91 -0.02 0.45 16 30 H 0.33 8.80 8.90 -74.06 -0.66 8.15 16 31 H 0.34 8.45 8.90 -74.06 -0.66 7.79 16 32 H 0.18 1.47 7.76 -2.91 -0.02 1.45 16 33 H 0.19 0.58 7.64 -2.91 -0.02 0.56 16 Total: -1.00 -99.46 309.22 -4.77 -104.23