REAL300018695747.mol2 38 1 O -0.67 -4.27 14.78 -20.23 -0.30 -4.57 16 2 C 0.50 2.58 7.00 36.00 0.25 2.83 16 3 O -0.62 -7.67 17.87 -20.22 -0.36 -8.03 16 4 C -0.01 0.03 2.53 -70.02 -0.18 -0.14 16 5 N -0.48 5.46 1.25 -110.46 -0.14 5.32 16 6 H 0.41 -6.55 8.59 -39.29 -0.34 -6.89 16 7 H 0.43 -4.85 6.72 -39.29 -0.26 -5.11 16 8 C 0.03 -0.38 5.11 -4.98 -0.03 -0.41 16 9 C -0.14 1.51 5.36 -104.53 -0.56 0.95 16 10 C -0.06 0.62 9.68 -39.63 -0.38 0.24 16 11 C -0.11 0.74 9.75 -39.25 -0.38 0.36 16 12 C 0.33 -1.02 9.80 -38.72 -0.38 -1.40 16 13 O -0.66 -3.33 17.25 -57.73 -1.00 -4.33 16 14 O -0.65 -3.45 17.25 -57.73 -1.00 -4.45 16 15 C -0.11 0.61 9.75 -39.25 -0.38 0.22 16 16 C -0.04 0.38 9.68 -39.63 -0.38 0.00 16 17 C -0.08 0.24 4.74 -104.64 -0.50 -0.26 16 18 C -0.13 0.50 9.30 -39.56 -0.37 0.13 16 19 C -0.09 0.26 10.04 -39.61 -0.40 -0.14 16 20 C -0.13 0.22 9.99 -39.43 -0.39 -0.18 16 21 C 0.12 -0.08 6.70 -39.22 -0.26 -0.35 16 22 O -0.49 0.38 13.50 -19.42 -0.26 0.11 16 23 C -0.11 0.14 9.61 -39.43 -0.38 -0.24 16 24 H 0.14 -0.96 7.95 -51.93 -0.41 -1.38 16 25 H 0.18 -1.21 5.59 -51.93 -0.29 -1.50 16 26 H 0.14 -1.84 8.06 -51.93 -0.42 -2.25 16 27 H 0.17 -2.44 8.06 -52.49 -0.42 -2.86 16 28 H 0.18 -1.09 7.77 -52.49 -0.41 -1.50 16 29 H 0.34 0.97 8.90 45.56 0.41 1.38 16 30 H 0.34 1.01 8.90 45.56 0.41 1.42 16 31 H 0.18 -0.85 7.77 -52.49 -0.41 -1.26 16 32 H 0.18 -1.71 8.06 -52.48 -0.42 -2.14 16 33 H 0.12 -0.81 6.72 -52.48 -0.35 -1.16 16 34 H 0.14 -0.63 8.06 -52.49 -0.42 -1.06 16 35 H 0.14 -0.36 8.06 -52.48 -0.42 -0.79 16 36 H 0.39 -2.41 9.06 45.56 0.41 -2.00 16 37 H 0.14 -0.25 8.04 -52.49 -0.42 -0.67 16 Total: 0.00 -30.51 327.26 -6.62 -37.13