B2XGK8 -OEChem-04012117092D 52 56 0 0 0 0 0 0 0999 V2000 6.6498 1.7445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 -1.7151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6814 -0.2959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6361 0.1274 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 0.0213 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -1.1781 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.1455 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3534 -1.0365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9867 0.6563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3307 -0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9641 0.8680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 -0.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0321 0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6134 0.3391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 0.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 0.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -0.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 0.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2854 -0.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9188 1.2914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -1.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 0.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2627 -0.1898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8961 1.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -0.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5681 0.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8289 -1.3671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5878 -1.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9627 1.2758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3724 0.7402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3547 -1.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9450 -0.9087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4886 1.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7296 1.4419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1795 -0.8382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9385 -1.0816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5566 0.5635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7976 0.8069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5139 -1.7655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.7655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0961 -0.9918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5021 1.7505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -1.7655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 1.3818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6794 -0.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0854 2.0934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -1.4317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1740 0.8937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 0.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 18 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 16 1 0 0 0 0 6 18 1 0 0 0 0 6 42 1 0 0 0 0 7 15 1 0 0 0 0 7 20 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 21 2 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 24 2 0 0 0 0 21 25 1 0 0 0 0 21 44 1 0 0 0 0 22 26 2 0 0 0 0 22 45 1 0 0 0 0 23 27 1 0 0 0 0 23 46 1 0 0 0 0 24 29 1 0 0 0 0 24 47 1 0 0 0 0 25 28 2 0 0 0 0 25 48 1 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 27 29 2 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END $$$$