D06PWA -OEChem-04152110343D 20 20 0 0 0 0 0 0 0999 V2000 -2.3362 2.0214 -0.2257 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6272 -0.4160 0.1212 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9698 0.8082 0.2479 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6881 -1.2942 -0.5738 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5784 0.8968 0.3565 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5191 -0.2523 -0.0239 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2262 0.9201 -0.1496 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1288 -1.4752 0.1504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6194 0.8697 -0.1012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2673 -0.3532 0.0731 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -1.5256 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9715 -0.1996 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2673 1.8783 -0.2947 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4238 -2.4030 0.2689 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -2.4845 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2331 -2.1162 -0.9555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7016 -1.2692 -0.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7223 2.7674 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8973 -1.3420 0.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2478 1.6718 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 18 1 0 0 0 0 2 10 1 0 0 0 0 2 19 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 11 2 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 15 1 0 0 0 0 M END $$$$