93G Converted by convert_cif2sdf.py 2024/03/29 11:09:15 40 42 0 0 0 0 0 0 0 0999 V2000 -4.3552 -1.8757 -0.3346 N 0 0 0 0 0 -3.1716 -2.3118 0.1830 C 0 0 0 0 0 -2.9857 -3.6577 0.3795 N 0 0 0 0 0 -2.2039 -1.4838 0.4987 N 0 0 0 0 0 -2.3421 -0.1551 0.3232 C 0 0 0 0 0 -3.5370 0.3431 -0.2057 C 0 0 0 0 0 -4.5642 -0.5562 -0.5391 C 0 0 0 0 0 -5.6183 -0.1550 -1.0019 O 0 0 0 0 0 -3.3870 1.7153 -0.2690 N 0 0 0 0 0 -2.1562 2.0019 0.2031 C 0 0 0 0 0 -1.5441 0.9020 0.5497 N 0 3 0 0 0 2.2273 0.4484 0.2969 C 0 0 0 0 0 6.2564 0.1274 1.1773 O 0 0 0 0 0 5.4671 -0.1743 -1.5172 C 0 0 0 0 0 5.0409 -0.3129 -2.7887 N 0 0 0 0 0 6.6523 -0.2646 -1.2601 O 0 0 0 0 0 4.9374 0.2324 0.8876 C 0 0 0 0 0 -0.1901 0.8309 1.1049 C 0 0 0 0 0 0.7949 0.5639 -0.0046 C 0 0 0 0 0 0.4036 0.4449 -1.1464 O 0 0 0 0 0 2.6798 0.5859 1.6173 C 0 0 0 0 0 3.1391 0.1963 -0.7304 C 0 0 0 0 0 4.0208 0.4778 1.9037 C 0 0 0 0 0 4.4952 0.0864 -0.4371 C 0 0 0 0 0 -4.3781 2.6777 -0.7573 C 0 0 0 0 0 -5.0480 -2.5154 -0.5619 H 0 0 0 0 0 -3.6919 -4.2838 0.1509 H 0 0 0 0 0 -2.1498 -3.9844 0.7468 H 0 0 0 0 0 -1.7389 2.9948 0.2821 H 0 0 0 0 0 6.5435 -0.7727 1.3843 H 0 0 0 0 0 5.6792 -0.4852 -3.4977 H 0 0 0 0 0 4.0958 -0.2415 -2.9931 H 0 0 0 0 0 0.0546 1.7762 1.5882 H 0 0 0 0 0 -0.1391 0.0250 1.8368 H 0 0 0 0 0 1.9732 0.7772 2.4105 H 0 0 0 0 0 2.7931 0.0855 -1.7469 H 0 0 0 0 0 4.3638 0.5894 2.9223 H 0 0 0 0 0 -5.0082 3.0024 0.0712 H 0 0 0 0 0 -3.8674 3.5404 -1.1839 H 0 0 0 0 0 -4.9962 2.2059 -1.5213 H 0 0 0 0 0 1 2 1 0 0 0 1 7 1 0 0 0 2 3 1 0 0 0 2 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 5 11 1 0 0 0 6 7 1 0 0 0 6 9 1 0 0 0 7 8 2 0 0 0 9 10 1 0 0 0 9 25 1 0 0 0 10 11 2 0 0 0 11 18 1 0 0 0 12 19 1 0 0 0 12 21 2 0 0 0 12 22 1 0 0 0 13 17 1 0 0 0 14 15 1 0 0 0 14 16 2 0 0 0 14 24 1 0 0 0 17 23 2 0 0 0 17 24 1 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 21 23 1 0 0 0 22 24 2 0 0 0 1 26 1 0 0 0 3 27 1 0 0 0 3 28 1 0 0 0 10 29 1 0 0 0 13 30 1 0 0 0 15 31 1 0 0 0 15 32 1 0 0 0 18 33 1 0 0 0 18 34 1 0 0 0 21 35 1 0 0 0 22 36 1 0 0 0 23 37 1 0 0 0 25 38 1 0 0 0 25 39 1 0 0 0 25 40 1 0 0 0 M END $$$$