97H Converted by convert_cif2sdf.py 2026/01/30 11:05:38 29 31 0 0 0 0 0 0 0 0999 V2000 -2.3535 -0.6450 -0.0039 C 0 0 0 0 0 -3.7368 -0.7333 -0.0027 C 0 0 0 0 0 -4.3573 -1.9853 -0.0058 N 0 0 0 0 0 -4.5072 0.4241 0.0024 C 0 0 0 0 0 -3.8991 1.6645 0.0055 C 0 0 0 0 0 -2.5224 1.7635 0.0043 C 0 0 0 0 0 -1.7400 0.6078 0.0051 C 0 0 0 0 0 -0.2654 0.7108 0.0040 C 0 0 0 0 0 0.4372 -0.3930 0.0047 N 0 0 0 0 0 1.7850 -0.3747 0.0036 C 0 0 0 0 0 2.5327 -1.5563 0.0055 C 0 0 0 0 0 3.8974 -1.4960 0.0033 C 0 0 0 0 0 4.5596 -0.2748 -0.0006 C 0 0 0 0 0 3.8500 0.9068 -0.0025 C 0 0 0 0 0 2.4571 0.8691 -0.0003 C 0 0 0 0 0 1.6479 2.0965 -0.0032 C 0 0 0 0 0 2.1683 3.1962 -0.0081 O 0 0 0 0 0 0.3014 1.9561 -0.0050 N 0 0 0 0 0 -1.7529 -1.5419 -0.0073 H 0 0 0 0 0 -3.8194 -2.7924 -0.0082 H 0 0 0 0 0 -5.3254 -2.0469 -0.0047 H 0 0 0 0 0 -5.5849 0.3528 0.0026 H 0 0 0 0 0 -4.5026 2.5603 0.0099 H 0 0 0 0 0 -2.0505 2.7355 0.0066 H 0 0 0 0 0 2.0319 -2.5127 0.0082 H 0 0 0 0 0 4.4700 -2.4113 0.0060 H 0 0 0 0 0 5.6389 -0.2514 -0.0017 H 0 0 0 0 0 4.3693 1.8532 -0.0052 H 0 0 0 0 0 -0.2654 2.7436 -0.0076 H 0 0 0 0 0 13 14 2 0 0 0 13 12 1 0 0 0 14 15 1 0 0 0 12 11 2 0 0 0 17 16 2 0 0 0 15 16 1 0 0 0 15 10 2 0 0 0 16 18 1 0 0 0 11 10 1 0 0 0 10 9 1 0 0 0 18 8 1 0 0 0 9 8 2 0 0 0 8 7 1 0 0 0 7 6 2 0 0 0 7 1 1 0 0 0 6 5 1 0 0 0 1 2 2 0 0 0 5 4 2 0 0 0 2 4 1 0 0 0 2 3 1 0 0 0 1 19 1 0 0 0 3 20 1 0 0 0 3 21 1 0 0 0 4 22 1 0 0 0 5 23 1 0 0 0 6 24 1 0 0 0 11 25 1 0 0 0 12 26 1 0 0 0 13 27 1 0 0 0 14 28 1 0 0 0 18 29 1 0 0 0 M END $$$$