CRR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 44 48 0 0 0 0 0 0 0 0999 V2000 2.1061 0.3801 -0.0644 C 0 0 0 0 0 1.9606 0.7781 1.2631 C 0 0 0 0 0 2.5832 1.9179 1.7051 C 0 0 0 0 0 3.3563 2.6767 0.8366 C 0 0 0 0 0 3.5107 2.2984 -0.4791 C 0 0 0 0 0 2.8882 1.1461 -0.9464 C 0 0 0 0 0 2.8531 0.5231 -2.1757 N 0 0 0 0 0 2.0849 -0.6011 -2.1129 C 0 0 0 0 0 1.5899 -0.7490 -0.8556 C 0 0 0 0 0 0.7141 -1.8376 -0.3743 C 0 0 0 0 0 1.1245 -3.0485 0.1699 C 0 0 0 0 0 2.5134 -3.4730 0.3682 C 0 0 0 0 0 3.4259 -2.7376 0.0452 O 0 0 0 0 0 2.7789 -4.6804 0.9101 O 0 0 0 0 0 0.0070 -3.7796 0.4894 N 0 0 0 0 0 -1.1124 -3.0566 0.1595 C 0 0 0 0 0 -2.4995 -3.4898 0.3448 C 0 0 0 0 0 -3.4150 -2.7604 0.0138 O 0 0 0 0 0 -2.7621 -4.6986 0.8840 O 0 0 0 0 0 -0.7049 -1.8392 -0.3760 C 0 0 0 0 0 -1.5841 -0.7541 -0.8583 C 0 0 0 0 0 -2.1089 0.3706 -0.0663 C 0 0 0 0 0 -1.9764 0.7615 1.2651 C 0 0 0 0 0 -2.6108 1.8952 1.7078 C 0 0 0 0 0 -3.3837 2.6521 0.8385 C 0 0 0 0 0 -3.5253 2.2809 -0.4800 C 0 0 0 0 0 -2.8898 1.1357 -0.9492 C 0 0 0 0 0 -2.8409 0.5196 -2.1818 N 0 0 0 0 0 -2.0611 -0.5968 -2.1205 C 0 0 0 0 0 1.3593 0.1908 1.9413 H 0 0 0 0 0 2.4713 2.2271 2.7335 H 0 0 0 0 0 3.8416 3.5718 1.1968 H 0 0 0 0 0 4.1149 2.8954 -1.1459 H 0 0 0 0 0 3.3092 0.8396 -2.9713 H 0 0 0 0 0 1.8935 -1.2697 -2.9390 H 0 0 0 0 0 3.7222 -4.8709 1.0017 H 0 0 0 0 0 0.0078 -4.6646 0.8865 H 0 0 0 0 0 -3.7057 -4.8965 0.9657 H 0 0 0 0 0 -1.3767 0.1752 1.9448 H 0 0 0 0 0 -2.5097 2.1991 2.7388 H 0 0 0 0 0 -3.8784 3.5418 1.1997 H 0 0 0 0 0 -4.1280 2.8768 -1.1493 H 0 0 0 0 0 -3.2928 0.8379 -2.9786 H 0 0 0 0 0 -1.8545 -1.2566 -2.9496 H 0 0 0 0 0 1 6 2 0 0 0 1 2 1 0 0 0 1 9 1 0 0 0 2 3 2 0 0 0 2 30 1 0 0 0 3 4 1 0 0 0 3 31 1 0 0 0 4 5 2 0 0 0 4 32 1 0 0 0 5 6 1 0 0 0 5 33 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 34 1 0 0 0 8 9 2 0 0 0 8 35 1 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 10 20 1 0 0 0 11 12 1 0 0 0 11 15 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 14 36 1 0 0 0 15 16 1 0 0 0 15 37 1 0 0 0 16 20 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 17 19 1 0 0 0 19 38 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 21 29 2 0 0 0 22 23 2 0 0 0 22 27 1 0 0 0 23 24 1 0 0 0 23 39 1 0 0 0 24 25 2 0 0 0 24 40 1 0 0 0 25 26 1 0 0 0 25 41 1 0 0 0 26 27 2 0 0 0 26 42 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 28 43 1 0 0 0 29 44 1 0 0 0 M END $$$$