BRBE03 -OEChem-04022116033D 30 33 0 0 0 0 0 0 0999 V2000 -1.2228 2.9826 0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -2.4634 0.0025 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0435 -0.2900 0.0009 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3846 1.6325 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4391 -0.4947 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1098 0.7339 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 1.0680 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0904 1.7837 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9562 -1.2476 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3272 -0.6587 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4842 0.8463 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1592 -1.6750 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4825 0.7437 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2128 -0.3430 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5576 -1.5898 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4451 -1.4996 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7759 1.2773 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7047 -0.2966 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7252 -0.9470 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 0.4372 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9707 1.8150 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6835 -2.6482 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1391 -2.5093 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3399 -2.5808 -0.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9237 2.3547 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0743 0.6432 -0.4262 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1208 -1.1077 -0.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0837 -0.3900 1.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5958 -1.5966 -0.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8898 0.8635 -0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 9 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 4 7 2 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 11 14 2 0 0 0 0 11 21 1 0 0 0 0 12 15 2 0 0 0 0 12 22 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 23 1 0 0 0 0 16 19 1 0 0 0 0 16 24 1 0 0 0 0 17 20 1 0 0 0 0 17 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 M END $$$$