52 C -0.01260 1.07580 0.00800 C -1.22590 1.74870 0.01740 C -1.26600 3.12660 0.03000 C -0.08130 3.85240 0.02260 C 1.14400 3.16520 0.00770 C 1.16470 1.77130 0.00050 C 2.17780 4.20710 0.00330 C 1.52750 5.37860 0.01520 O 0.19920 5.17090 0.02660 C 2.18900 6.73260 0.01540 N 2.39060 7.17930 -1.36940 C 3.34730 6.30700 -2.07140 C 3.58950 6.87910 -3.44590 C 3.26800 8.14730 -3.78890 N 3.61930 8.31200 -5.09070 C 4.14920 7.13820 -5.50840 N 4.12600 6.28800 -4.51430 C 2.63850 9.13200 -2.83750 C 2.81240 8.58640 -1.41280 H 3.86590 8.62650 -1.09910 C 1.96780 9.39310 -0.46040 N 2.39750 10.29110 0.39070 C 1.29360 10.74890 1.02390 N 0.26930 10.10240 0.53000 O 0.64030 9.32220 -0.32140 C 1.25260 11.78600 2.08370 C 2.43190 12.39230 2.51300 C 2.39300 13.35700 3.49830 C 1.18210 13.72690 4.06480 C -0.00040 13.12350 3.63910 C 0.03420 12.15980 2.64790 O -1.04060 13.65720 4.34420 C -0.44210 14.29490 5.48800 O 0.88100 14.63770 5.03560 H 0.00210 -0.00410 0.00200 H -2.14840 1.18720 0.01870 H -2.21580 3.64050 0.04150 H 2.10660 1.24300 -0.01070 H 3.24760 4.05930 -0.00750 H 1.54800 7.45370 0.54370 H 3.16190 6.66530 0.52430 H 4.29080 6.26870 -1.50720 H 2.92760 5.29350 -2.15330 H 4.52130 6.86150 -6.39440 H 3.13760 10.10730 -2.93590 H 1.57030 9.24110 -3.07630 H 3.37650 12.10660 2.07430 H 3.30800 13.82540 3.82970 H -0.88140 11.69440 2.31420 H -1.03110 15.18230 5.76300 H -0.42400 13.59060 6.33280 H 3.44690 9.27740 -5.58900