JMG Converted by convert_cif2sdf.py 2024/03/29 11:09:15 22 23 0 0 0 0 0 0 0 0999 V2000 -2.4017 1.5195 -0.0065 C 0 0 0 0 0 -4.0683 -0.6978 -0.0003 C 0 0 0 0 0 3.9187 1.8398 0.0025 O 0 0 0 0 0 3.5402 0.5441 0.0002 C 0 0 0 0 0 4.3807 -0.3346 0.0017 O 0 0 0 0 0 2.1185 0.1977 -0.0046 C 0 0 0 0 0 1.6184 -1.0756 -0.0019 C 0 0 0 0 0 0.2528 -1.1527 -0.0019 C 0 0 0 0 0 -0.3889 0.0525 -0.0036 C 0 0 0 0 0 0.7937 1.3538 -0.0064 S 0 0 0 0 0 -1.8553 0.2352 -0.0038 C 0 0 0 0 0 -3.7707 1.6834 0.0003 C 0 0 0 0 0 -4.6035 0.5777 0.0039 C 0 0 0 0 0 -2.7001 -0.8757 -0.0012 C 0 0 0 0 0 -1.7526 2.3840 -0.0080 H 0 0 0 0 0 -4.7236 -1.5564 0.0022 H 0 0 0 0 0 4.8761 1.9689 0.0054 H 0 0 0 0 0 2.2518 -1.9499 -0.0004 H 0 0 0 0 0 -0.2766 -2.0936 0.0006 H 0 0 0 0 0 -4.1947 2.6773 0.0027 H 0 0 0 0 0 -5.6748 0.7122 0.0038 H 0 0 0 0 0 -2.2840 -1.8728 -0.0036 H 0 0 0 0 0 2 14 2 0 0 0 2 13 1 0 0 0 14 11 1 0 0 0 13 12 2 0 0 0 8 9 2 0 0 0 8 7 1 0 0 0 11 9 1 0 0 0 11 1 2 0 0 0 9 10 1 0 0 0 7 6 2 0 0 0 12 1 1 0 0 0 6 10 1 0 0 0 6 4 1 0 0 0 5 4 2 0 0 0 4 3 1 0 0 0 1 15 1 0 0 0 2 16 1 0 0 0 3 17 1 0 0 0 7 18 1 0 0 0 8 19 1 0 0 0 12 20 1 0 0 0 13 21 1 0 0 0 14 22 1 0 0 0 M END $$$$