B9HJR7 -OEChem-04022118403D 43 45 0 0 0 0 0 0 0999 V2000 1.1195 0.1895 0.9427 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -0.1623 1.8768 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2817 1.7239 0.0401 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4418 1.1064 0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7132 1.6013 0.5243 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8476 0.6650 0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3492 -0.1884 0.1476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 0.2388 0.7258 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0402 -0.5957 -0.2688 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4773 -0.6181 -0.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0921 1.5597 -1.3382 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1402 -0.8971 -1.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2441 -1.1331 -1.2561 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 0.8104 -0.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -0.3501 1.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1934 0.5784 -0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1514 -1.8370 -0.0696 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5833 0.5563 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6309 -0.0595 -1.2374 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -1.2200 0.8427 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5413 -1.8592 0.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2573 -0.6626 0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9552 -1.0748 -0.3376 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7006 1.6282 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9157 2.6091 0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6155 1.7064 1.6123 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9364 -1.2400 -1.6638 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5059 0.8541 -2.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0119 1.6382 -1.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5132 2.5526 -1.5234 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6273 -1.6715 -2.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3339 1.5973 -1.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6166 -0.4739 2.0483 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6857 1.5382 -0.1806 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6103 -2.7800 -0.0946 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1988 0.0536 -2.1562 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4793 -2.0098 1.5438 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0652 -2.8087 0.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3344 -0.7526 0.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7758 -1.7520 -0.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0934 2.6502 0.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1435 1.1264 -0.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9951 1.1607 1.1037 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 2 8 2 0 0 0 0 3 18 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 14 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 31 1 0 0 0 0 14 19 1 0 0 0 0 14 32 1 0 0 0 0 15 20 2 0 0 0 0 15 33 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 21 2 0 0 0 0 17 35 1 0 0 0 0 18 22 2 0 0 0 0 19 23 2 0 0 0 0 19 36 1 0 0 0 0 20 23 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END $$$$