91S Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 52 0 0 0 0 0 0 0 0999 V2000 -6.9175 -0.2843 -1.6240 O 0 0 0 0 0 -6.3762 -0.5604 -0.5744 C 0 0 0 0 0 -7.2090 -0.8955 0.6366 C 0 0 0 0 0 -8.6936 -0.8148 0.2740 C 0 0 0 0 0 -5.0313 -0.5729 -0.4915 N 0 0 0 0 0 -4.2006 -0.2545 -1.6632 C 0 0 0 0 0 -3.1817 0.8163 -1.2607 C 0 0 0 0 0 -4.3561 -0.8988 0.7730 C 0 0 0 0 0 -3.3303 0.1991 1.0751 C 0 0 0 0 0 -2.4399 0.3623 -0.0764 N 0 0 0 0 0 -1.4047 1.2247 0.2198 C 0 0 0 0 0 -1.6443 2.4898 0.5382 N 0 0 0 0 0 -0.6614 3.3287 0.8248 C 0 0 0 0 0 0.6023 2.9767 0.8153 N 0 0 0 0 0 0.9559 1.7196 0.5062 C 0 0 0 0 0 -0.0609 0.7817 0.1974 C 0 0 0 0 0 0.2782 -0.5393 -0.1223 C 0 0 0 0 0 1.5852 -0.9210 -0.1311 C 0 0 0 0 0 1.9974 -2.5593 -0.5289 CL 0 0 0 0 0 2.2966 1.3118 0.4871 C 0 0 0 0 0 3.2801 2.1892 0.7852 F 0 0 0 0 0 2.6034 -0.0046 0.1772 C 0 0 0 0 0 4.0181 -0.4451 0.1607 C 0 0 0 0 0 4.7703 -0.3508 -1.0145 C 0 0 0 0 0 4.2057 0.1455 -2.1463 O 0 0 0 0 0 4.6083 -0.9509 1.3192 C 0 0 0 0 0 3.8916 -1.0417 2.4610 F 0 0 0 0 0 5.9299 -1.3599 1.2980 C 0 0 0 0 0 6.6667 -1.2689 0.1305 C 0 0 0 0 0 6.0921 -0.7651 -1.0205 C 0 0 0 0 0 -6.9710 -1.9048 0.9725 H 0 0 0 0 0 -6.9910 -0.1864 1.4352 H 0 0 0 0 0 -9.2945 -1.0573 1.1494 H 0 0 0 0 0 -8.9306 0.1945 -0.0619 H 0 0 0 0 0 -8.9106 -1.5240 -0.5246 H 0 0 0 0 0 -3.6774 -1.1517 -1.9951 H 0 0 0 0 0 -4.8312 0.1231 -2.4674 H 0 0 0 0 0 -2.4870 0.9849 -2.0832 H 0 0 0 0 0 -3.7029 1.7455 -1.0281 H 0 0 0 0 0 -5.0886 -0.9461 1.5782 H 0 0 0 0 0 -3.8475 -1.8592 0.6795 H 0 0 0 0 0 -3.8496 1.1375 1.2698 H 0 0 0 0 0 -2.7438 -0.0815 1.9497 H 0 0 0 0 0 -0.9104 4.3485 1.0767 H 0 0 0 0 0 -0.4956 -1.2534 -0.3624 H 0 0 0 0 0 4.2988 1.1033 -2.2450 H 0 0 0 0 0 6.3871 -1.7512 2.1944 H 0 0 0 0 0 7.6981 -1.5896 0.1209 H 0 0 0 0 0 6.6754 -0.6926 -1.9268 H 0 0 0 0 0 4 3 1 0 0 0 1 2 2 0 0 0 3 2 1 0 0 0 2 5 1 0 0 0 5 6 1 0 0 0 5 8 1 0 0 0 6 7 1 0 0 0 8 9 1 0 0 0 7 10 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 19 18 1 0 0 0 17 18 2 0 0 0 17 16 1 0 0 0 11 16 2 0 0 0 11 12 1 0 0 0 18 22 1 0 0 0 16 15 1 0 0 0 12 13 2 0 0 0 27 26 1 0 0 0 22 20 2 0 0 0 22 23 1 0 0 0 15 20 1 0 0 0 15 14 2 0 0 0 13 14 1 0 0 0 26 23 2 0 0 0 26 28 1 0 0 0 20 21 1 0 0 0 23 24 1 0 0 0 28 29 2 0 0 0 24 25 1 0 0 0 24 30 2 0 0 0 29 30 1 0 0 0 3 31 1 0 0 0 3 32 1 0 0 0 4 33 1 0 0 0 4 34 1 0 0 0 4 35 1 0 0 0 6 36 1 0 0 0 6 37 1 0 0 0 7 38 1 0 0 0 7 39 1 0 0 0 8 40 1 0 0 0 8 41 1 0 0 0 9 42 1 0 0 0 9 43 1 0 0 0 13 44 1 0 0 0 17 45 1 0 0 0 25 46 1 0 0 0 28 47 1 0 0 0 29 48 1 0 0 0 30 49 1 0 0 0 M END $$$$