B4K5YS -OEChem-04022117083D 38 40 0 0 0 0 0 0 0999 V2000 4.4719 -1.9866 -0.5547 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7795 0.2704 0.4058 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6391 -0.7622 0.5505 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9911 1.0495 -0.6878 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 1.3583 -2.3593 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0019 -0.6275 0.4782 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1962 0.5104 -0.2998 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 0.2625 -0.1612 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6606 -0.0106 0.6565 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6769 0.3160 -0.2198 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1963 -0.1062 0.7478 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0492 -1.3802 1.0104 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5067 0.9374 -0.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3778 -1.0534 0.0889 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 -0.9627 0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3012 1.1208 1.1398 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4232 0.1698 0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3469 -0.9410 0.7282 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5738 0.1970 -0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6904 1.2115 1.0534 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0701 0.8921 -1.4016 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7007 -1.9258 -1.9612 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3722 1.4606 0.9217 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1523 -1.5038 1.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1677 -0.5315 1.6802 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8705 -2.2630 1.6136 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6934 1.8202 -1.1765 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8715 -1.9393 -0.2872 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7406 1.9385 1.5855 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1944 -1.4965 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5938 0.5136 -0.2518 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 2.1199 1.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2737 -1.0299 -2.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7506 -1.9345 -2.5048 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2786 -2.8071 -2.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0499 2.3465 0.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4539 1.3706 0.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2031 1.5615 1.9992 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 22 1 0 0 0 0 2 17 1 0 0 0 0 2 23 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 24 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 21 3 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 2 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 25 1 0 0 0 0 12 18 1 0 0 0 0 12 26 1 0 0 0 0 13 19 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 17 2 0 0 0 0 16 20 2 0 0 0 0 16 29 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$