9TX Converted by convert_cif2sdf.py 2024/03/29 11:09:15 42 42 0 0 0 0 0 0 0 0999 V2000 -4.5568 -0.6045 -0.1845 C 0 0 0 0 0 -6.3820 0.9124 0.1813 C 0 0 0 0 0 -6.8815 0.0670 1.1724 C 0 0 0 0 0 -6.2230 -1.1083 1.4681 C 0 0 0 0 0 -5.0602 -1.4418 0.7946 C 0 0 0 0 0 8.1101 0.4230 1.4636 O 0 0 0 0 0 7.4556 1.0083 0.6345 C 0 0 0 0 0 7.6616 2.3168 0.4163 O 0 0 0 0 0 6.4065 0.2691 -0.1557 C 0 0 0 0 0 6.6799 -1.1735 -0.1044 N 0 0 0 0 0 5.0266 0.5475 0.4431 C 0 0 0 0 0 3.9503 -0.1001 -0.4317 C 0 0 0 0 0 2.5704 0.1784 0.1671 C 0 0 0 0 0 1.4951 -0.4694 -0.7067 C 0 0 0 0 0 0.1738 -0.2023 -0.1331 N 0 0 0 0 0 -0.9320 -0.6789 -0.7379 C 0 0 0 0 0 -0.8333 -1.3302 -1.7592 O 0 0 0 0 0 -2.1473 -0.4342 -0.2118 O 0 0 0 0 0 -3.2936 -0.9788 -0.9168 C 0 0 0 0 0 -5.2121 0.5686 -0.4968 C 0 0 0 0 0 -7.0675 2.1289 -0.1385 C 0 0 0 0 0 -7.6291 3.1256 -0.4013 C 0 0 0 0 0 -7.7859 0.3280 1.7015 H 0 0 0 0 0 -6.6079 -1.7644 2.2350 H 0 0 0 0 0 -4.5439 -2.3596 1.0362 H 0 0 0 0 0 8.3452 2.7481 0.9465 H 0 0 0 0 0 6.4272 0.6056 -1.1925 H 0 0 0 0 0 6.6659 -1.5100 0.8464 H 0 0 0 0 0 6.0289 -1.6863 -0.6789 H 0 0 0 0 0 4.9762 0.1316 1.4491 H 0 0 0 0 0 4.8596 1.6240 0.4863 H 0 0 0 0 0 4.0007 0.3158 -1.4376 H 0 0 0 0 0 4.1173 -1.1766 -0.4748 H 0 0 0 0 0 2.5200 -0.2377 1.1740 H 0 0 0 0 0 2.4044 1.2549 0.2103 H 0 0 0 0 0 1.5455 -0.0535 -1.7127 H 0 0 0 0 0 1.6611 -1.5459 -0.7499 H 0 0 0 0 0 0.0940 0.3170 0.6822 H 0 0 0 0 0 -3.2085 -2.0637 -0.9637 H 0 0 0 0 0 -3.3251 -0.5712 -1.9275 H 0 0 0 0 0 -4.8201 1.2189 -1.2655 H 0 0 0 0 0 -8.1314 4.0170 -0.6358 H 0 0 0 0 0 4 3 2 0 0 0 4 5 1 0 0 0 3 2 1 0 0 0 5 1 2 0 0 0 2 21 1 0 0 0 2 20 2 0 0 0 21 22 3 0 0 0 1 20 1 0 0 0 1 19 1 0 0 0 19 18 1 0 0 0 15 16 1 0 0 0 15 14 1 0 0 0 18 16 1 0 0 0 16 17 2 0 0 0 14 13 1 0 0 0 13 12 1 0 0 0 12 11 1 0 0 0 6 7 2 0 0 0 7 9 1 0 0 0 7 8 1 0 0 0 11 9 1 0 0 0 9 10 1 0 0 0 3 23 1 0 0 0 4 24 1 0 0 0 5 25 1 0 0 0 8 26 1 0 0 0 9 27 1 0 0 0 10 28 1 0 0 0 10 29 1 0 0 0 11 30 1 0 0 0 11 31 1 0 0 0 12 32 1 0 0 0 12 33 1 0 0 0 13 34 1 0 0 0 13 35 1 0 0 0 14 36 1 0 0 0 14 37 1 0 0 0 15 38 1 0 0 0 19 39 1 0 0 0 19 40 1 0 0 0 20 41 1 0 0 0 22 42 1 0 0 0 M END $$$$