B78AGS -OEChem-04012115522D 37 39 0 0 0 0 0 0 0999 V2000 3.4030 -0.7095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 -1.7095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -1.5755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.1565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2329 2.4849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5901 0.7901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -2.5142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 0.0458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.2095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 0.2520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -0.9048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -1.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 1.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 1.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5256 1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1899 2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8363 2.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1684 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9007 1.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1399 -3.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.4105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8409 -2.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9397 0.9473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7758 3.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4429 2.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3610 3.6929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4255 3.0742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 17 1 0 0 0 0 2 32 1 0 0 0 0 5 25 1 0 0 0 0 5 37 1 0 0 0 0 6 25 2 0 0 0 0 7 12 1 0 0 0 0 7 17 1 0 0 0 0 7 27 1 0 0 0 0 8 10 2 0 0 0 0 8 14 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 13 15 2 0 0 0 0 13 18 1 0 0 0 0 14 17 2 0 0 0 0 15 26 1 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 25 1 0 0 0 0 21 23 1 0 0 0 0 21 33 1 0 0 0 0 22 24 1 0 0 0 0 22 34 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 $$$$