JGB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 23 23 0 0 0 0 0 0 0 0999 V2000 3.5043 -0.5354 -0.2157 C 0 0 0 0 0 2.0999 -0.2576 0.1238 C 0 0 0 0 0 1.1122 -1.1419 -0.2524 C 0 0 0 0 0 -0.2968 -0.7896 -0.0639 C 0 0 0 0 0 -0.7164 0.5400 -0.2174 C 0 0 0 0 0 -2.0446 0.8656 -0.0386 C 0 0 0 0 0 -2.9684 -0.1269 0.2941 C 0 0 0 0 0 -2.5540 -1.4446 0.4468 C 0 0 0 0 0 -1.2317 -1.7804 0.2653 C 0 0 0 0 0 1.7598 0.9313 0.8458 C 0 0 0 0 0 4.4700 0.3289 0.1523 N 0 0 0 0 0 1.4896 1.8749 1.4176 N 0 0 0 0 0 3.7936 -1.5485 -0.8241 O 0 0 0 0 0 -2.4552 2.1535 -0.1867 O 0 0 0 0 0 -4.2749 0.1963 0.4699 O 0 0 0 0 0 1.3768 -2.0946 -0.6865 H 0 0 0 0 0 -0.0008 1.3077 -0.4745 H 0 0 0 0 0 -3.2733 -2.2079 0.7039 H 0 0 0 0 0 -0.9132 -2.8051 0.3842 H 0 0 0 0 0 4.2396 1.1350 0.6412 H 0 0 0 0 0 5.3965 0.1459 -0.0718 H 0 0 0 0 0 -2.7255 2.3788 -1.0871 H 0 0 0 0 0 -4.8053 0.1430 -0.3373 H 0 0 0 0 0 15 7 1 0 0 0 8 7 2 0 0 0 8 9 1 0 0 0 7 6 1 0 0 0 9 4 2 0 0 0 6 14 1 0 0 0 6 5 2 0 0 0 4 5 1 0 0 0 4 3 1 0 0 0 3 2 2 0 0 0 2 10 1 0 0 0 2 1 1 0 0 0 13 1 2 0 0 0 10 12 3 0 0 0 1 11 1 0 0 0 3 16 1 0 0 0 5 17 1 0 0 0 8 18 1 0 0 0 9 19 1 0 0 0 11 20 1 0 0 0 11 21 1 0 0 0 14 22 1 0 0 0 15 23 1 0 0 0 M END $$$$