B5SPL2 -OEChem-04042105583D 39 41 0 0 0 0 0 0 0999 V2000 -1.8850 3.1033 0.1585 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3125 -1.9116 -1.2062 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0387 -1.0172 0.7804 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1353 1.9752 -1.7834 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8249 1.2463 0.0258 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8097 0.3859 0.3987 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0157 -0.1090 0.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7431 -0.6235 0.3447 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7447 1.2160 -0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4918 1.4921 0.2039 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0912 2.8943 0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5491 2.0307 -0.6276 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9628 0.0283 -0.9137 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1572 -0.9048 0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0791 -0.7322 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5794 1.6864 0.7318 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5813 -2.0121 0.4859 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9456 -0.2833 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6957 0.9260 1.0799 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9777 -2.2846 0.1522 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7135 -2.8304 0.3863 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3788 -2.2984 -2.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8693 -1.9773 1.8213 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5413 1.9404 -0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3813 3.8806 0.4302 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0325 2.4457 1.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2516 -0.2753 -1.6728 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1373 -0.4787 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4171 2.6318 1.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6031 -2.4458 0.6676 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3691 1.2836 1.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8391 -2.9439 0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6056 -3.9067 0.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3667 -1.5888 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -2.4683 -1.7936 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7202 -3.2572 -2.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8247 -2.4855 1.9776 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1183 -2.7225 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5784 -1.4841 2.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 15 1 0 0 0 0 2 22 1 0 0 0 0 3 18 1 0 0 0 0 3 23 1 0 0 0 0 4 12 2 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 8 17 2 0 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 14 20 1 0 0 0 0 14 28 1 0 0 0 0 15 18 2 0 0 0 0 16 19 2 0 0 0 0 16 29 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$