BB6J1Q -OEChem-04012118252D 39 41 0 0 0 0 0 0 0999 V2000 5.2531 3.9253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.2305 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.4258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -3.1810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.6210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -3.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -3.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.2305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 2.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 3.1810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 3.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1815 -3.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8396 -3.9939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5741 -3.5151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0953 -2.7806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8596 -3.5113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -4.3868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7826 -4.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 0.9459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 0.0742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 2.4858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8848 1.6141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0273 2.7806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5061 3.5151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7716 3.9939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 10 2 0 0 0 0 4 8 2 0 0 0 0 4 20 1 0 0 0 0 5 14 1 0 0 0 0 5 20 2 0 0 0 0 6 14 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 13 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 15 18 1 0 0 0 0 15 30 1 0 0 0 0 16 19 2 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$