BERQ35 -OEChem-04022103173D 38 41 0 0 0 0 0 0 0999 V2000 0.2784 -3.6969 -0.2818 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7565 1.6249 -0.4456 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1587 0.6881 -1.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3452 -1.2632 0.0596 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1861 -0.5736 -0.0192 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5086 -1.6574 0.1664 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8592 -2.8660 0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9256 -1.2405 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0297 -2.7124 0.4729 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5939 -0.7126 0.1679 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2034 -0.4820 -0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5764 -2.6056 -0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8436 0.7061 0.2625 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2798 0.5929 -0.9254 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3212 -0.8489 0.7097 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6164 1.3620 -0.6956 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3023 1.4211 1.3308 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4738 1.3009 -1.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5153 -0.1410 0.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5915 0.9340 -0.3122 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8479 2.7331 -0.5856 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5338 2.7923 1.4409 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3066 3.4484 0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8603 1.1962 0.3507 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9834 -3.1336 0.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9642 -2.8013 1.5626 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4237 0.8913 -1.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2865 -1.6683 1.4221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7028 0.9284 2.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5278 2.1363 -1.7545 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3433 -0.4761 1.1888 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 3.2578 -1.3242 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1136 3.3490 2.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 4.5159 0.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6592 1.3117 -2.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7028 1.8553 0.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6529 1.3096 1.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1704 0.1776 0.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 2 20 1 0 0 0 0 2 24 1 0 0 0 0 3 16 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 8 2 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 2 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 15 28 1 0 0 0 0 16 21 2 0 0 0 0 17 22 1 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 22 23 2 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$