J0K Converted by convert_cif2sdf.py 2024/03/29 11:09:15 63 70 0 0 0 0 0 0 0 0999 V2000 14.8145 7.6565 12.9016 N 0 0 0 0 0 13.0765 9.2718 12.7827 C 0 0 0 0 0 26.0177 6.5057 13.6116 N 0 0 0 0 0 15.1678 10.2060 13.2267 C 0 0 0 0 0 15.7160 8.7820 13.1715 C 0 0 0 0 0 17.1267 8.3880 13.3319 C 0 0 0 0 0 25.8736 5.8248 11.2728 O 0 0 0 0 0 16.2272 3.8414 12.9853 C 0 0 0 0 0 14.7704 4.0690 13.4180 C 0 0 0 0 0 14.1156 3.7371 14.7822 C 0 0 0 0 0 14.0463 4.6744 12.2118 C 0 0 0 0 0 12.5613 5.0330 12.1399 C 0 0 0 0 0 15.0435 4.8460 11.0881 C 0 0 0 0 0 14.7599 5.3554 9.6907 C 0 0 0 0 0 17.3693 3.2724 13.8480 C 0 0 0 0 0 16.3709 4.3397 11.5449 C 0 0 0 0 0 17.6303 4.2717 10.7291 C 0 0 0 0 0 15.6966 5.8627 12.8250 IR 0 0 0 0 0 16.2453 5.6110 15.1492 CL 0 0 0 0 0 13.5628 7.9862 12.7301 C 0 0 0 0 0 13.3297 11.6085 13.1120 O 0 0 0 0 0 13.8520 10.3759 13.0401 C 0 0 0 0 0 25.4299 6.8279 12.2107 S 0 0 0 0 0 23.7693 6.6561 12.3017 C 0 0 0 0 0 25.6436 8.2359 11.9385 O 0 0 0 0 0 22.9074 7.6908 11.7175 C 0 0 0 0 0 21.5388 7.5164 11.7840 C 0 0 0 0 0 23.0785 5.5293 12.9087 C 0 0 0 0 0 21.7117 5.5000 12.9385 C 0 0 0 0 0 18.7787 6.6519 13.3831 C 0 0 0 0 0 19.6019 6.3854 12.3596 C 0 0 0 0 0 20.9696 6.4648 12.3858 C 0 0 0 0 0 17.3933 6.9913 13.1932 N 0 0 0 0 0 17.9256 9.2940 13.5518 O 0 0 0 0 0 12.0211 9.4225 12.6114 H 0 0 0 0 0 25.7151 7.1965 14.2677 H 0 0 0 0 0 25.7007 5.6040 13.9066 H 0 0 0 0 0 15.8189 11.0478 13.4097 H 0 0 0 0 0 13.0547 4.0278 14.7609 H 0 0 0 0 0 14.1959 2.6567 14.9738 H 0 0 0 0 0 14.6310 4.2903 15.5804 H 0 0 0 0 0 12.3318 5.4495 11.1477 H 0 0 0 0 0 11.9573 4.1286 12.3066 H 0 0 0 0 0 12.3266 5.7785 12.9138 H 0 0 0 0 0 15.6924 5.3644 9.1070 H 0 0 0 0 0 14.0275 4.6964 9.2015 H 0 0 0 0 0 14.3540 6.3756 9.7485 H 0 0 0 0 0 18.2933 3.2316 13.2534 H 0 0 0 0 0 17.5249 3.9199 14.7233 H 0 0 0 0 0 17.1045 2.2593 14.1838 H 0 0 0 0 0 17.4460 4.7005 9.7328 H 0 0 0 0 0 18.4249 4.8416 11.2329 H 0 0 0 0 0 17.9430 3.2221 10.6241 H 0 0 0 0 0 12.8584 7.1918 12.5323 H 0 0 0 0 0 14.0192 12.2349 13.2973 H 0 0 0 0 0 23.3320 8.5655 11.2477 H 0 0 0 0 0 20.9007 8.2603 11.3312 H 0 0 0 0 0 23.6451 4.7150 13.3358 H 0 0 0 0 0 21.2165 4.6721 13.4232 H 0 0 0 0 0 18.7890 5.7583 14.0236 H 0 0 0 0 0 19.2287 7.4966 13.9248 H 0 0 0 0 0 19.3785 5.3475 12.0721 H 0 0 0 0 0 19.2890 7.0644 11.5534 H 0 0 0 0 0 1 5 2 0 0 0 1 18 1 0 0 0 1 20 1 0 0 0 2 20 2 0 0 0 2 22 1 0 0 0 3 23 1 0 0 0 4 5 1 0 0 0 4 22 2 0 0 0 5 6 1 0 0 0 6 33 1 0 0 0 6 34 2 0 0 0 7 23 2 0 0 0 8 9 1 0 0 0 8 15 1 0 0 0 8 16 1 0 0 0 8 18 1 0 0 0 9 10 1 0 0 0 9 11 1 0 0 0 9 18 1 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 11 18 1 0 0 0 13 14 1 0 0 0 13 16 1 0 0 0 13 18 1 0 0 0 16 17 1 0 0 0 16 18 1 0 0 0 18 33 1 0 0 0 21 22 1 0 0 0 23 24 1 0 0 0 23 25 2 0 0 0 24 26 2 0 0 0 24 28 1 0 0 0 26 27 1 0 0 0 27 32 2 0 0 0 28 29 2 0 0 0 29 32 1 0 0 0 30 31 1 0 0 0 30 33 1 0 0 0 31 32 1 0 0 0 18 19 1 0 0 0 2 35 1 0 0 0 3 36 1 0 0 0 3 37 1 0 0 0 4 38 1 0 0 0 10 39 1 0 0 0 10 40 1 0 0 0 10 41 1 0 0 0 12 42 1 0 0 0 12 43 1 0 0 0 12 44 1 0 0 0 14 45 1 0 0 0 14 46 1 0 0 0 14 47 1 0 0 0 15 48 1 0 0 0 15 49 1 0 0 0 15 50 1 0 0 0 17 51 1 0 0 0 17 52 1 0 0 0 17 53 1 0 0 0 20 54 1 0 0 0 21 55 1 0 0 0 26 56 1 0 0 0 27 57 1 0 0 0 28 58 1 0 0 0 29 59 1 0 0 0 30 60 1 0 0 0 30 61 1 0 0 0 31 62 1 0 0 0 31 63 1 0 0 0 M END $$$$