D08NNF -OEChem-10101305032D 37 40 0 0 0 0 0 0 0999 V2000 4.6660 -2.9398 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.5602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.5602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.9398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2392 2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -0.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -2.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -1.4190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1049 1.3230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6776 1.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6776 2.7057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3866 2.7057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3866 1.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9705 3.4128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0936 3.4128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -0.2852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.2852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -3.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -1.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -2.7727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.7727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 9 2 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 3 29 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 10 12 1 0 0 0 0 10 14 2 0 0 0 0 11 13 1 0 0 0 0 11 15 2 0 0 0 0 12 16 2 0 0 0 0 13 17 2 0 0 0 0 14 19 1 0 0 0 0 14 30 1 0 0 0 0 15 18 1 0 0 0 0 15 31 1 0 0 0 0 16 21 1 0 0 0 0 16 32 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 37 1 0 0 0 0 21 36 1 0 0 0 0 M END $$$$