D0LJ1B -OEChem-10121501572D 40 40 0 1 0 0 0 0 0999 V2000 5.4641 3.3170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 4.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 2.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3170 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.2656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.5753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -4.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -3.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 2.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 1.2800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 3.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 3.2800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 4.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 19 1 0 0 0 0 2 18 2 0 0 0 0 5 18 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 20 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 1 0 0 0 8 18 1 0 0 0 0 8 23 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 M END $$$$