BRU91O -OEChem-04012120182D 31 33 0 0 0 0 0 0 0999 V2000 4.2746 -3.0724 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3176 -2.6600 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.1110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 2.9385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 1.2064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.2677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 2.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.8772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -0.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 2.0724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 -1.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3426 -0.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 -2.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6747 -0.9652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9854 -1.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 3.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.8824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2384 -1.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0681 -0.8373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3819 2.9385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 22 1 0 0 0 0 3 11 2 0 0 0 0 4 17 1 0 0 0 0 4 31 1 0 0 0 0 5 17 2 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 23 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 12 24 1 0 0 0 0 13 16 1 0 0 0 0 13 25 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 19 21 2 0 0 0 0 19 29 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 M END $$$$