44 C 1.20780 -0.68310 -0.01310 C 0.00210 -0.00410 0.00200 C -0.01660 1.37490 0.00960 C 1.18620 2.08660 0.00190 C 2.40000 1.39390 -0.01340 C 2.40280 0.01480 -0.02080 C 1.17470 3.55990 0.00950 C 2.33330 4.24110 0.00210 C 2.32180 5.71250 0.00960 C 1.10980 6.40790 0.01860 C 1.10340 7.78570 0.03090 C 2.29430 8.50250 0.02340 C 3.50860 7.81290 0.00860 C 3.52910 6.43060 0.00190 N 4.74530 5.75080 -0.01190 N 2.06510 9.87790 0.03290 C 0.62570 10.15000 0.04810 H 0.33780 10.71110 -0.84090 C -0.04710 8.76780 0.04710 C 0.25160 10.91470 1.29160 C 0.85300 10.60900 2.49810 C 0.51330 11.31360 3.63790 C -0.43510 12.31730 3.57300 C -1.04070 12.61910 2.36760 C -0.69720 11.91800 1.22680 H 1.21620 -1.76300 -0.01870 H -0.92660 -0.55540 0.00760 H -0.95840 1.90350 0.01690 H 3.33330 1.93720 -0.01940 H 3.33990 -0.52190 -0.03230 H 0.23520 4.09260 0.02090 H 3.27270 3.70840 -0.00940 H 0.17650 5.86450 0.02040 H 4.43790 8.36310 0.00270 H 4.75870 4.78090 -0.01630 H 5.57850 6.24750 -0.01720 H 2.75840 10.55630 0.02960 H -0.64700 8.63620 0.94760 H -0.66570 8.64650 -0.84210 H 1.59090 9.82210 2.54960 H 0.98610 11.07750 4.57970 H -0.70320 12.86530 4.46420 H -1.78190 13.40300 2.31690 H -1.17030 12.15380 0.28500