D0PI2E -OEChem-10101305032D 41 42 0 1 0 0 0 0 0999 V2000 3.7320 0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.5000 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 2.8660 -5.5000 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 4.7320 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 6.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 3.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 4.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -3.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -4.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 6 1 0 0 0 0 2 8 2 0 0 0 0 2 25 1 0 0 0 0 3 7 1 0 0 0 0 3 9 2 0 0 0 0 3 24 1 0 0 0 0 6 41 1 0 0 0 0 7 40 1 0 0 0 0 10 19 1 0 0 0 0 10 25 1 0 0 0 0 10 34 1 0 0 0 0 11 18 1 0 0 0 0 11 24 1 0 0 0 0 11 35 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 15 2 0 0 0 0 13 17 1 0 0 0 0 14 20 1 0 0 0 0 14 27 1 0 0 0 0 15 21 1 0 0 0 0 15 26 1 0 0 0 0 16 22 2 0 0 0 0 16 29 1 0 0 0 0 17 23 2 0 0 0 0 17 28 1 0 0 0 0 18 20 2 0 0 0 0 18 22 1 0 0 0 0 19 21 2 0 0 0 0 19 23 1 0 0 0 0 20 31 1 0 0 0 0 21 30 1 0 0 0 0 22 33 1 0 0 0 0 23 32 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 M END $$$$