B3E0YJ -OEChem-04012116242D 38 40 0 0 0 0 0 0 0999 V2000 5.1871 0.6559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0582 1.8932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8335 0.1178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -2.6484 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 1.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 1.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -0.0884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 2.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7905 0.5302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4118 2.4313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 0.7364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0796 1.6870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3688 2.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1236 1.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5303 1.1556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2475 -0.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 -1.8437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.0337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0192 2.6865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5979 -0.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.3068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.3806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6044 3.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1830 0.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9581 2.6511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5614 3.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7795 3.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 12 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 4 25 1 0 0 0 0 5 13 2 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 12 14 2 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 28 1 0 0 0 0 16 19 1 0 0 0 0 16 29 1 0 0 0 0 17 20 2 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$