BRU3D0 -OEChem-04022117233D 28 30 0 0 0 0 0 0 0999 V2000 -0.2593 -0.8142 0.0957 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1177 -1.9938 0.4037 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2886 0.0807 -0.0458 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1038 -0.5436 -0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4379 -0.6798 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8047 -2.0389 0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5837 0.7141 0.3326 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3122 1.4484 -0.3208 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9479 0.9844 0.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9667 -1.5349 -0.4626 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6941 -0.0552 0.0726 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8214 -0.0049 -0.2267 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 -1.2646 -0.5702 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 2.0539 -0.3952 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 1.3173 -0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 2.3312 0.5917 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2206 -2.9326 0.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9658 1.4749 0.7952 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4392 2.0450 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6182 -2.5205 -0.7581 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6098 -0.6189 0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8866 0.1923 -0.3145 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0109 -2.0334 -0.9257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6397 3.1147 -0.6237 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7060 1.8150 -0.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6436 2.3866 1.6714 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4168 2.5452 0.0788 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7669 3.1178 0.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 2 5 1 0 0 0 0 2 6 2 0 0 0 0 3 5 1 0 0 0 0 3 8 2 0 0 0 0 4 7 1 0 0 0 0 4 10 2 0 0 0 0 5 11 2 0 0 0 0 6 17 1 0 0 0 0 7 9 2 0 0 0 0 7 18 1 0 0 0 0 8 14 1 0 0 0 0 8 19 1 0 0 0 0 9 12 1 0 0 0 0 9 16 1 0 0 0 0 10 13 1 0 0 0 0 10 20 1 0 0 0 0 11 15 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 M END $$$$