REAL300009850847.mol2 46 1 O -0.68 -23.05 17.72 -20.22 -0.36 -23.41 16 2 C 0.51 15.39 4.56 36.01 0.16 15.55 16 3 O -0.68 -21.67 16.06 -20.22 -0.32 -22.00 16 4 C -0.15 -3.55 0.44 -156.59 -0.07 -3.62 16 5 C 0.57 13.39 4.64 -10.99 -0.05 13.34 16 6 O -0.55 -13.73 15.55 5.56 0.09 -13.65 16 7 N -0.62 -11.85 3.32 -170.62 -0.57 -12.42 16 8 C 0.09 1.64 5.17 -2.21 -0.01 1.63 16 9 C -0.11 -1.38 6.27 -24.97 -0.16 -1.54 16 10 C -0.09 -0.91 0.93 -154.49 -0.14 -1.05 16 11 C -0.11 -0.89 6.78 -26.46 -0.18 -1.07 16 12 C -0.17 -0.96 3.34 -89.59 -0.30 -1.26 16 13 C 0.39 1.90 9.38 37.16 0.35 2.25 16 14 O -0.75 -12.65 17.78 -57.73 -1.03 -13.68 16 15 O -0.70 -11.08 16.99 -57.73 -0.98 -12.06 16 16 C -0.09 -0.43 6.96 -26.46 -0.18 -0.62 16 17 C 0.13 1.78 6.37 -3.53 -0.02 1.75 16 18 C -0.06 -1.27 4.52 -28.17 -0.13 -1.39 16 19 C -0.13 -2.42 8.95 -35.90 -0.32 -2.74 16 20 C -0.17 -3.11 9.62 -35.67 -0.34 -3.45 16 21 C -0.09 -1.62 5.63 -27.94 -0.16 -1.78 16 22 C -0.09 -1.84 3.98 -26.51 -0.11 -1.94 16 23 H 0.07 1.06 7.06 -51.93 -0.37 0.70 16 24 H 0.11 2.42 4.99 -51.93 -0.26 2.16 16 25 H 0.08 1.11 8.14 -51.93 -0.42 0.69 16 26 H 0.09 0.91 8.06 -51.93 -0.42 0.49 16 27 H 0.09 0.64 7.77 -51.93 -0.40 0.24 16 28 H 0.09 0.96 8.12 -51.93 -0.42 0.54 16 29 H 0.14 0.97 8.14 -51.93 -0.42 0.55 16 30 H 0.14 0.18 8.14 -51.92 -0.42 -0.24 16 31 H 0.14 0.20 7.85 -51.93 -0.41 -0.21 16 32 H 0.32 4.90 8.90 45.56 0.41 5.31 16 33 H 0.33 4.72 8.90 45.56 0.41 5.13 16 34 H 0.10 0.45 8.12 -51.93 -0.42 0.03 16 35 H 0.10 0.25 8.10 -51.93 -0.42 -0.17 16 36 H 0.07 0.98 8.09 -51.93 -0.42 0.56 16 37 H 0.06 0.84 7.86 -51.93 -0.41 0.44 16 38 H 0.08 1.94 7.74 -51.93 -0.40 1.54 16 39 H 0.07 1.65 8.10 -51.93 -0.42 1.23 16 40 H 0.10 1.64 8.06 -52.49 -0.42 1.21 16 41 H 0.09 1.43 8.06 -52.49 -0.42 1.00 16 42 H 0.07 1.00 8.14 -51.93 -0.42 0.57 16 43 H 0.06 1.09 7.42 -51.93 -0.39 0.70 16 44 H 0.07 1.54 8.12 -51.93 -0.42 1.12 16 45 H 0.07 1.48 5.36 -51.92 -0.28 1.20 16 Total: -1.00 -45.95 354.25 -7.07 -53.03