B3YPT5 -OEChem-04012115092D 36 39 0 0 0 0 0 0 0999 V2000 6.8497 -1.1111 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6278 -2.2336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.1154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.7248 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6097 -0.8323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 -2.4201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8277 2.9201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8007 -1.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 -2.7291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3323 -0.6513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5233 -1.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2278 0.3433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2458 -1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0368 0.9310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0549 -0.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9503 0.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9323 1.9256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -0.5260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.1101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6581 -3.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5449 -0.2157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6614 0.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3107 -1.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6213 -0.7224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4519 0.8887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 19 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 26 1 0 0 0 0 4 9 2 0 0 0 0 4 10 1 0 0 0 0 5 16 1 0 0 0 0 5 19 1 0 0 0 0 5 32 1 0 0 0 0 6 16 2 0 0 0 0 6 17 1 0 0 0 0 7 25 3 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 11 1 0 0 0 0 10 13 2 0 0 0 0 11 17 2 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 M END $$$$