REAL300009850856.mol2 46 1 O -0.68 -21.11 14.52 -20.23 -0.29 -21.40 16 2 C 0.51 15.05 5.34 36.01 0.19 15.24 16 3 O -0.68 -22.12 17.58 -20.23 -0.36 -22.48 16 4 C -0.15 -3.52 0.43 -156.63 -0.07 -3.58 16 5 C 0.57 12.81 4.75 -10.98 -0.05 12.76 16 6 O -0.56 -13.36 14.17 5.56 0.08 -13.28 16 7 N -0.60 -11.15 3.08 -170.77 -0.53 -11.67 16 8 C 0.09 1.51 4.66 -2.35 -0.01 1.50 16 9 C -0.10 -1.34 6.26 -25.10 -0.16 -1.50 16 10 C -0.09 -0.90 0.94 -154.49 -0.14 -1.04 16 11 C -0.11 -0.94 6.95 -26.46 -0.18 -1.13 16 12 C -0.17 -0.99 3.18 -89.59 -0.29 -1.28 16 13 C 0.39 1.93 9.53 37.16 0.35 2.28 16 14 O -0.71 -11.30 16.53 -57.73 -0.95 -12.25 16 15 O -0.75 -12.63 17.78 -57.73 -1.03 -13.65 16 16 C -0.09 -0.45 6.87 -26.45 -0.18 -0.63 16 17 C 0.13 1.78 6.37 -3.52 -0.02 1.75 16 18 C -0.13 -2.64 4.71 -26.59 -0.13 -2.76 16 19 C 0.06 1.08 6.62 37.21 0.25 1.33 16 20 O -0.39 -7.36 10.77 -35.23 -0.38 -7.74 16 21 C 0.05 1.00 6.55 37.20 0.24 1.24 16 22 C -0.11 -2.52 4.50 -26.60 -0.12 -2.64 16 23 H 0.11 2.52 4.58 -51.92 -0.24 2.28 16 24 H 0.05 0.74 7.01 -51.93 -0.36 0.38 16 25 H 0.08 0.81 8.06 -51.93 -0.42 0.39 16 26 H 0.09 1.38 8.14 -51.93 -0.42 0.96 16 27 H 0.09 0.62 7.90 -51.93 -0.41 0.21 16 28 H 0.09 0.99 8.12 -51.93 -0.42 0.57 16 29 H 0.15 1.11 7.73 -51.93 -0.40 0.71 16 30 H 0.14 0.14 8.14 -51.93 -0.42 -0.29 16 31 H 0.14 0.25 7.85 -51.93 -0.41 -0.16 16 32 H 0.33 4.78 8.90 45.56 0.41 5.18 16 33 H 0.32 4.92 8.90 45.56 0.41 5.32 16 34 H 0.10 0.43 8.12 -51.93 -0.42 0.01 16 35 H 0.10 0.26 7.97 -51.93 -0.41 -0.15 16 36 H 0.07 1.09 8.09 -51.93 -0.42 0.67 16 37 H 0.06 0.76 7.86 -51.93 -0.41 0.35 16 38 H 0.07 1.31 4.98 -51.93 -0.26 1.05 16 39 H 0.09 1.82 8.03 -51.93 -0.42 1.40 16 40 H 0.09 1.23 8.14 -51.93 -0.42 0.81 16 41 H 0.04 0.67 7.38 -51.93 -0.38 0.29 16 42 H 0.08 1.41 8.14 -51.93 -0.42 0.99 16 43 H 0.07 1.43 5.80 -51.93 -0.30 1.13 16 44 H 0.08 1.82 8.03 -51.92 -0.42 1.40 16 45 H 0.07 1.64 8.03 -51.93 -0.42 1.22 16 Total: -1.00 -45.05 347.98 -5.92 -50.98