REAL300013493717.mol2 37 1 C -0.14 -2.65 9.73 37.16 0.36 -2.29 16 2 C -0.10 -1.81 5.36 -26.73 -0.14 -1.95 16 3 C -0.18 -3.77 2.28 -91.77 -0.21 -3.98 16 4 C 0.16 2.91 5.02 -4.04 -0.02 2.89 16 5 N -0.71 -11.57 5.35 -65.22 -0.35 -11.92 16 6 C 0.71 9.91 8.41 -86.91 -0.73 9.18 16 7 O -0.57 -9.10 13.79 5.29 0.07 -9.03 16 8 N -0.68 -6.67 5.34 -14.22 -0.08 -6.75 16 9 C 0.24 2.03 6.29 -83.69 -0.53 1.50 16 10 C -0.10 -0.76 8.70 -39.40 -0.34 -1.10 16 11 C -0.04 -0.18 10.04 -39.61 -0.40 -0.58 16 12 C -0.13 -0.84 8.62 -39.55 -0.34 -1.18 16 13 C 0.40 3.83 4.82 -39.61 -0.19 3.64 16 14 F -0.14 -2.74 16.67 2.25 0.04 -2.71 16 15 F -0.17 -2.56 15.31 2.25 0.03 -2.52 16 16 F -0.17 -2.74 15.30 2.25 0.03 -2.70 16 17 F -0.17 -2.62 15.31 2.25 0.03 -2.58 16 18 F -0.17 -2.66 15.32 2.25 0.03 -2.62 16 19 C -0.16 -1.34 8.54 -39.39 -0.34 -1.68 16 20 C 0.50 14.35 5.33 36.01 0.19 14.55 16 21 O -0.70 -22.41 17.98 -20.23 -0.36 -22.78 16 22 O -0.69 -22.22 17.50 -20.22 -0.35 -22.58 16 23 H 0.06 1.31 7.38 -51.93 -0.38 0.93 16 24 H 0.05 0.71 8.14 -51.93 -0.42 0.29 16 25 H 0.05 0.82 8.14 -51.93 -0.42 0.40 16 26 H 0.05 0.78 8.14 -51.93 -0.42 0.35 16 27 H 0.07 1.38 7.97 -51.93 -0.41 0.96 16 28 H 0.07 1.39 8.12 -51.93 -0.42 0.97 16 29 H 0.06 0.97 8.14 -51.93 -0.42 0.55 16 30 H 0.08 1.57 7.97 -51.93 -0.41 1.15 16 31 H 0.41 6.49 8.25 -40.82 -0.34 6.16 16 32 H 0.42 3.15 8.84 -40.82 -0.36 2.79 16 33 H 0.18 1.58 6.24 -52.49 -0.33 1.25 16 34 H 0.18 0.15 8.06 -52.48 -0.42 -0.28 16 35 H 0.18 0.93 7.39 -52.49 -0.39 0.54 16 36 H 0.19 1.44 7.39 -52.49 -0.39 1.06 16 Total: -1.00 -40.94 331.18 -4.14 -45.07