REAL300009850687.mol2 44 1 O -0.69 -20.90 16.39 -20.22 -0.33 -21.24 16 2 C 0.51 14.34 6.64 36.01 0.24 14.58 16 3 O -0.68 -21.33 17.67 -20.23 -0.36 -21.69 16 4 C -0.15 -3.18 0.55 -156.82 -0.09 -3.26 16 5 C 0.56 11.17 4.18 -10.99 -0.05 11.12 16 6 O -0.53 -10.81 11.32 5.56 0.06 -10.74 16 7 N -0.66 -11.16 4.55 -9.88 -0.04 -11.20 16 8 C 0.21 3.09 6.25 -83.75 -0.52 2.56 16 9 C -0.16 -1.75 9.69 -38.96 -0.38 -2.13 16 10 C -0.02 -0.24 5.74 -106.77 -0.61 -0.85 16 11 C -0.06 -0.43 9.73 -39.52 -0.38 -0.82 16 12 C -0.11 -1.05 9.65 -39.64 -0.38 -1.44 16 13 C 0.31 3.86 9.78 -38.67 -0.38 3.48 16 14 O -0.69 -12.31 17.20 -57.73 -0.99 -13.30 16 15 O -0.69 -12.51 17.19 -57.73 -0.99 -13.51 16 16 C -0.07 -0.81 9.49 -38.78 -0.37 -1.17 16 17 C -0.04 -0.47 5.74 -106.82 -0.61 -1.09 16 18 C -0.08 -0.89 9.74 -39.48 -0.38 -1.27 16 19 C -0.09 -1.30 8.55 -39.76 -0.34 -1.64 16 20 C -0.09 -1.63 4.55 -26.73 -0.12 -1.75 16 21 C -0.12 -1.77 5.70 -26.73 -0.15 -1.92 16 22 C -0.12 -1.67 5.92 -26.73 -0.16 -1.83 16 23 C -0.13 -2.20 5.63 -26.71 -0.15 -2.35 16 24 C -0.08 -1.54 4.29 -26.71 -0.11 -1.66 16 25 H 0.42 6.72 7.99 -40.82 -0.33 6.40 16 26 H 0.14 1.14 8.06 -52.49 -0.42 0.72 16 27 H 0.17 0.66 8.06 -52.49 -0.42 0.24 16 28 H 0.17 1.45 7.73 -52.49 -0.41 1.04 16 29 H 0.33 4.94 8.90 45.56 0.41 5.35 16 30 H 0.33 5.03 8.90 45.56 0.41 5.43 16 31 H 0.18 1.80 7.73 -52.48 -0.41 1.39 16 32 H 0.14 1.27 8.06 -52.49 -0.42 0.85 16 33 H 0.15 2.55 6.39 -52.48 -0.34 2.22 16 34 H 0.06 0.92 7.46 -51.93 -0.39 0.53 16 35 H 0.08 1.54 8.09 -51.93 -0.42 1.12 16 36 H 0.06 0.74 8.14 -51.93 -0.42 0.32 16 37 H 0.05 0.81 7.22 -51.93 -0.37 0.43 16 38 H 0.06 0.84 8.14 -51.93 -0.42 0.42 16 39 H 0.05 0.68 8.14 -51.93 -0.42 0.26 16 40 H 0.05 0.80 8.14 -51.93 -0.42 0.38 16 41 H 0.09 1.54 5.51 -51.93 -0.29 1.25 16 42 H 0.07 1.48 8.09 -51.93 -0.42 1.06 16 43 H 0.06 1.29 8.10 -51.93 -0.42 0.87 16 Total: -1.00 -39.31 354.99 -8.19 -47.50