B8QG2T -OEChem-04012120042D 29 31 0 1 0 0 0 0 0999 V2000 5.9405 1.2360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6651 2.4140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.0219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 2.5466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.6314 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.9286 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4026 1.7386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9422 2.2360 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7523 2.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.8266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 0.4895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9425 2.1543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 1.3246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8463 2.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8012 3.1366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0999 3.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 3.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -0.8266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1674 2.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.0166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.1366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.1366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 2 26 1 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 22 1 0 0 0 0 5 14 2 0 0 0 0 5 15 1 0 0 0 0 6 13 2 0 0 0 0 6 17 1 0 0 0 0 7 16 1 0 0 0 0 7 17 2 0 0 0 0 8 16 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 17 27 1 0 0 0 0 M END $$$$