BTU2I4 -OEChem-04012112252D 38 41 0 0 0 0 0 0 0999 V2000 4.6783 -4.1370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 0.7364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 1.2745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.3323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.5770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 0.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -0.8327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 0.1178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -0.4203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 1.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 2.4313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1886 2.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 3.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4993 3.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8529 4.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8314 4.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 -0.9606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 -1.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 0.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8848 -0.2924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5069 1.7360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6027 2.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9356 3.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1059 3.7158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4388 4.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 4.9216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 16 1 0 0 0 0 2 18 2 0 0 0 0 3 11 1 0 0 0 0 3 18 1 0 0 0 0 3 30 1 0 0 0 0 4 9 2 0 0 0 0 5 16 2 0 0 0 0 5 20 1 0 0 0 0 6 17 1 0 0 0 0 6 20 2 0 0 0 0 7 17 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 16 1 0 0 0 0 10 17 2 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 31 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 25 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$