BU5KE2 -OEChem-04012116202D 37 38 0 0 0 0 0 0 0999 V2000 2.0000 3.8627 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7320 3.8627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.5580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.3627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.1675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3627 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2781 -1.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -1.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 -2.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 -2.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8564 -3.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6643 -1.6366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2575 -2.1689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 -0.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 0.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8704 -1.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2772 -1.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -0.4799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -1.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9534 -2.7934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 -3.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1596 -2.8249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5663 -2.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2671 -4.0554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0490 -4.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4458 -3.6701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.5527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 2 6 2 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 5 14 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 15 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 2 0 0 0 0 16 35 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 M CHG 2 1 -1 6 1 M END $$$$