9SR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 39 42 0 0 0 0 0 0 0 0999 V2000 -2.1603 -1.1043 -0.2983 N 0 0 0 0 0 -3.1865 -0.1950 -0.4281 C 0 0 0 0 0 -1.6546 1.6919 -0.3547 C 0 0 0 0 0 -0.5615 0.6762 -0.7150 C 0 0 0 0 0 3.2717 0.7313 -0.3176 C 0 0 0 0 0 1.6095 -1.0826 0.1555 C 0 0 0 0 0 1.8814 0.1894 -0.6571 C 0 0 0 0 0 0.8081 1.2256 -0.3069 C 0 0 0 0 0 0.6117 0.2540 1.8885 C 0 0 0 0 0 -0.7877 -0.2927 1.5714 C 0 0 0 0 0 -0.8339 -0.6129 0.0750 C 0 0 0 0 0 0.2429 -1.6465 -0.2524 C 0 0 0 0 0 -2.9748 1.0798 -0.4650 N 0 0 0 0 0 -4.4775 -0.6574 -0.5218 N 0 0 0 0 0 1.5808 -0.7364 1.5432 O 0 0 0 0 0 1.8078 -0.1056 -2.0540 O 0 0 0 0 0 0.8376 1.4310 1.1086 O 0 0 0 0 0 0.7057 0.5525 3.2825 O 0 0 0 0 0 -1.7754 0.6904 1.8878 O 0 0 0 0 0 -1.5812 2.8025 -1.2505 O 0 0 0 0 0 -0.0144 -2.8506 0.4723 O 0 0 0 0 0 4.2574 -0.2531 -0.6355 O 0 0 0 0 0 -1.5001 2.0411 0.6665 H 0 0 0 0 0 -0.5838 0.4704 -1.7858 H 0 0 0 0 0 3.4608 1.6357 -0.8968 H 0 0 0 0 0 3.3202 0.9649 0.7466 H 0 0 0 0 0 2.3882 -1.8210 -0.0371 H 0 0 0 0 0 1.0018 2.1598 -0.8339 H 0 0 0 0 0 -0.9689 -1.1998 2.1488 H 0 0 0 0 0 0.2354 -1.8548 -1.3212 H 0 0 0 0 0 -4.6538 -1.6109 -0.4972 H 0 0 0 0 0 -5.2121 -0.0303 -0.6141 H 0 0 0 0 0 2.4434 -0.7719 -2.3493 H 0 0 0 0 0 1.5681 0.8936 3.5551 H 0 0 0 0 0 -1.7981 0.9369 2.8224 H 0 0 0 0 0 -2.2436 3.4877 -1.0829 H 0 0 0 0 0 0.6326 -3.5517 0.3114 H 0 0 0 0 0 5.1639 0.0233 -0.4445 H 0 0 0 0 0 -2.3156 -2.0505 -0.4471 H 0 0 0 0 0 14 2 1 0 0 0 13 2 2 0 0 0 13 3 1 0 0 0 19 10 1 0 0 0 2 1 1 0 0 0 20 3 1 0 0 0 3 4 1 0 0 0 1 11 1 0 0 0 10 11 1 0 0 0 10 9 1 0 0 0 18 9 1 0 0 0 4 11 1 0 0 0 4 8 1 0 0 0 11 12 1 0 0 0 17 9 1 0 0 0 17 8 1 0 0 0 9 15 1 0 0 0 8 7 1 0 0 0 12 21 1 0 0 0 12 6 1 0 0 0 15 6 1 0 0 0 7 6 1 0 0 0 7 16 1 0 0 0 7 5 1 0 0 0 22 5 1 0 0 0 3 23 1 0 0 0 4 24 1 0 0 0 5 25 1 0 0 0 5 26 1 0 0 0 6 27 1 0 0 0 8 28 1 0 0 0 10 29 1 0 0 0 12 30 1 0 0 0 14 31 1 0 0 0 14 32 1 0 0 0 16 33 1 0 0 0 18 34 1 0 0 0 19 35 1 0 0 0 20 36 1 0 0 0 21 37 1 0 0 0 22 38 1 0 0 0 1 39 1 0 0 0 M END $$$$