B7YGA3 -OEChem-04042106073D 39 41 0 0 0 0 0 0 0999 V2000 -4.6144 -1.9801 0.2157 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 0.0522 0.0353 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2282 0.4342 -0.1228 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.6532 -0.0008 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7405 2.1632 -0.2755 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2689 1.4103 -0.1269 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7237 -0.7961 0.4837 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0538 1.4316 0.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3241 -0.6467 0.0909 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3111 0.3392 0.0146 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9717 -2.1958 0.6119 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9038 -1.3329 -0.2162 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6163 1.0515 -0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9762 -0.2922 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9501 1.6836 -0.0779 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6017 2.0382 -0.1241 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1478 0.5707 -0.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1498 1.3453 -0.1704 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5219 -0.0845 -0.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4816 0.9733 -0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7579 0.1477 0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2189 -1.3261 -0.6384 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1867 -2.3234 -0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -2.0103 -0.0227 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -1.9768 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1986 -3.2554 0.4591 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9459 -1.5348 0.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7823 -1.5218 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2642 -1.1043 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7111 2.4577 -0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3328 3.0887 -0.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0875 2.4092 -0.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1686 1.9039 -1.1129 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2004 2.0351 0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2598 -1.5559 -1.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9897 -3.3134 -0.9838 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2011 -2.7525 0.0391 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9811 1.5581 1.3285 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3005 1.9764 1.3419 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 10 1 0 0 0 0 2 12 1 0 0 0 0 3 18 1 0 0 0 0 3 20 1 0 0 0 0 4 17 2 0 0 0 0 5 20 2 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 6 32 1 0 0 0 0 7 21 1 0 0 0 0 7 24 2 0 0 0 0 8 21 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M END $$$$