9RQ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 45 47 0 0 0 0 0 0 0 0999 V2000 -6.2076 -0.7075 -0.2600 C 0 0 0 0 0 4.7324 0.7358 0.4807 C 0 0 0 0 0 -7.1032 -0.1723 -1.1666 C 0 0 0 0 0 -6.9279 1.1180 -1.6319 C 0 0 0 0 0 1.8917 0.3785 1.2361 C 0 0 0 0 0 -5.8570 1.8733 -1.1886 C 0 0 0 0 0 -4.9635 1.3381 -0.2809 C 0 0 0 0 0 -0.1283 -0.9058 1.1970 C 0 0 0 0 0 0.5835 0.2265 1.5911 C 0 0 0 0 0 2.5246 -0.6092 0.4705 C 0 0 0 0 0 3.9277 -0.4726 0.0749 C 0 0 0 0 0 -5.1378 0.0477 0.1833 C 0 0 0 0 0 -2.3864 -1.2374 -0.8830 O 0 0 0 0 0 -2.4720 -0.4191 0.5006 P 0 0 0 0 0 -4.1619 -0.5359 1.1724 C 0 0 0 0 0 -4.2434 0.2418 2.4882 C 0 0 0 0 0 -1.4296 -1.0426 1.5576 O 0 0 0 0 0 4.2369 2.1576 -0.5303 S 0 0 0 0 0 5.1107 3.3003 -0.0314 O 0 0 0 0 0 4.6390 1.9744 -1.8811 O 0 0 0 0 0 2.9139 2.5620 -0.2088 O 0 0 0 0 0 4.4846 -1.4646 -0.6666 C 0 0 0 0 0 3.7105 -2.5849 -1.0335 C 0 0 0 0 0 2.4240 -2.7033 -0.6687 O 0 0 0 0 0 4.2221 -3.4681 -1.6994 O 0 0 0 0 0 1.8108 -1.7536 0.0695 C 0 0 0 0 0 0.4819 -1.8919 0.4392 C 0 0 0 0 0 -2.1356 1.0010 0.2558 O 0 0 0 0 0 -6.3476 -1.7140 0.1067 H 0 0 0 0 0 -7.9384 -0.7616 -1.5129 H 0 0 0 0 0 -7.6261 1.5363 -2.3408 H 0 0 0 0 0 2.4370 1.2593 1.5405 H 0 0 0 0 0 -5.7200 2.8808 -1.5522 H 0 0 0 0 0 -4.1272 1.9273 0.0653 H 0 0 0 0 0 0.0955 0.9873 2.1814 H 0 0 0 0 0 -2.5948 -2.1772 -0.7975 H 0 0 0 0 0 -3.9958 1.2875 2.3070 H 0 0 0 0 0 -5.2541 0.1716 2.8898 H 0 0 0 0 0 -3.5379 -0.1802 3.2038 H 0 0 0 0 0 5.5170 -1.3959 -0.9759 H 0 0 0 0 0 -0.0765 -2.7659 0.1373 H 0 0 0 0 0 -4.4094 -1.5816 1.3536 H 0 0 0 0 0 4.5510 0.9566 1.5322 H 0 0 0 0 0 5.7927 0.5335 0.3294 H 0 0 0 0 0 4.9564 4.1407 -0.4849 H 0 0 0 0 0 1 3 2 0 0 0 1 12 1 0 0 0 2 11 1 0 0 0 2 18 1 0 0 0 3 4 1 0 0 0 4 6 2 0 0 0 5 9 2 0 0 0 5 10 1 0 0 0 6 7 1 0 0 0 7 12 2 0 0 0 8 9 1 0 0 0 8 17 1 0 0 0 8 27 2 0 0 0 10 11 1 0 0 0 10 26 2 0 0 0 11 22 2 0 0 0 12 15 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 14 17 1 0 0 0 14 28 2 0 0 0 15 16 1 0 0 0 18 19 1 0 0 0 18 20 2 0 0 0 18 21 2 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 23 25 2 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 1 29 1 0 0 0 2 43 1 0 0 0 2 44 1 0 0 0 3 30 1 0 0 0 4 31 1 0 0 0 5 32 1 0 0 0 6 33 1 0 0 0 7 34 1 0 0 0 9 35 1 0 0 0 13 36 1 0 0 0 15 42 1 0 0 0 16 37 1 0 0 0 16 38 1 0 0 0 16 39 1 0 0 0 19 45 1 0 0 0 22 40 1 0 0 0 27 41 1 0 0 0 M END $$$$