CCC Converted by convert_cif2sdf.py 2026/01/30 11:05:38 37 39 0 0 0 0 0 0 0 0999 V2000 0.5479 -3.8749 0.4384 P 0 0 0 0 0 0.6715 -4.9190 1.4802 O 0 0 0 0 0 0.3674 -4.5008 -1.0335 O 0 0 0 0 0 4.5652 2.0828 0.2275 P 0 0 0 0 0 4.1368 2.5201 -1.1197 O 0 0 0 0 0 5.0570 3.3604 1.0739 O 0 0 0 0 0 5.7778 1.0325 0.0895 O 0 0 0 0 0 3.3294 1.3801 0.9822 O 0 0 0 0 0 2.9416 0.2605 0.1853 C 0 0 0 0 0 1.7636 -0.4557 0.8507 C 0 0 0 0 0 0.6284 0.4297 0.9500 O 0 0 0 0 0 1.2748 -1.6255 -0.0306 C 0 0 0 0 0 1.8190 -2.8543 0.4844 O 0 0 0 0 0 -0.2601 -1.6137 0.1447 C 0 0 0 0 0 -0.6701 -2.8457 0.7858 O 0 0 0 0 0 -0.5161 -0.4352 1.1094 C 0 0 0 0 0 -1.7446 0.2711 0.7369 N 0 0 0 0 0 -1.8624 0.8063 -0.4915 C 0 0 0 0 0 -0.9419 0.6972 -1.2843 O 0 0 0 0 0 -2.9679 1.4531 -0.8554 N 0 0 0 0 0 -3.9844 1.5867 -0.0137 C 0 0 0 0 0 -5.1210 2.2568 -0.4016 N 0 0 0 0 0 -3.8902 1.0418 1.2828 C 0 0 0 0 0 -2.7623 0.3818 1.6368 C 0 0 0 0 0 -0.3960 -5.0926 -0.9939 H 0 0 0 0 0 5.7964 3.7508 0.5880 H 0 0 0 0 0 6.0259 0.7736 0.9868 H 0 0 0 0 0 3.7808 -0.4289 0.0946 H 0 0 0 0 0 2.6441 0.6032 -0.8047 H 0 0 0 0 0 2.0499 -0.8182 1.8375 H 0 0 0 0 0 1.5554 -1.4784 -1.0739 H 0 0 0 0 0 -0.7841 -1.4671 -0.7999 H 0 0 0 0 0 -0.5818 -0.7926 2.1362 H 0 0 0 0 0 -5.1818 2.6345 -1.2927 H 0 0 0 0 0 -5.8642 2.3496 0.2152 H 0 0 0 0 0 -4.7090 1.1407 1.9799 H 0 0 0 0 0 -2.6679 -0.0486 2.6227 H 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 13 1 0 0 0 1 15 1 0 0 0 3 25 1 0 0 0 4 5 2 0 0 0 4 6 1 0 0 0 4 7 1 0 0 0 4 8 1 0 0 0 6 26 1 0 0 0 7 27 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 9 28 1 0 0 0 9 29 1 0 0 0 10 11 1 0 0 0 10 12 1 0 0 0 10 30 1 0 0 0 11 16 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 12 31 1 0 0 0 14 15 1 0 0 0 14 16 1 0 0 0 14 32 1 0 0 0 16 17 1 0 0 0 16 33 1 0 0 0 17 18 1 0 0 0 17 24 1 0 0 0 18 19 2 0 0 0 18 20 1 0 0 0 20 21 2 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 22 34 1 0 0 0 22 35 1 0 0 0 23 24 2 0 0 0 23 36 1 0 0 0 24 37 1 0 0 0 M END $$$$