B2MRL3 -OEChem-04022109253D 31 33 0 0 0 0 0 0 0999 V2000 -0.9830 -2.4871 -0.0221 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 1.7686 0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -2.4407 -0.0171 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8308 -0.3096 0.0034 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9268 0.0866 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4266 1.5013 0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9122 1.5929 -0.3629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7454 0.5176 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2865 -0.8983 -0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7927 -0.9916 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4453 -0.3347 -0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5387 -1.7214 -0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6596 0.3617 0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 -1.6549 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7199 2.4844 1.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7332 2.5251 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2906 1.9048 1.0279 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 2.1327 -0.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2932 2.5893 -0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0222 1.4718 -1.4484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8054 0.6375 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6558 0.6546 1.4333 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6408 -1.1349 -1.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7378 -1.6230 0.6557 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7227 -2.1705 -0.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 2.3993 1.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9803 2.0782 1.9874 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5006 3.5490 1.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2863 3.5174 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1859 2.0127 -2.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7698 2.6551 -1.5377 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 13 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 12 2 0 0 0 0 3 14 1 0 0 0 0 4 13 1 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 M END $$$$