L2J7QX -OEChem-05022323332D 44 46 0 1 0 0 0 0 0999 V2000 12.3193 2.0578 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.6795 3.3190 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.4183 2.6791 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 0.1806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0582 1.4179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8335 -0.3575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.8190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -3.1237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 0.5930 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4763 1.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 0.7993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 2.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -1.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 1.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7905 0.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4118 1.9560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 0.2612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -2.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0796 1.2117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3688 2.3684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5374 0.4652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9294 1.6294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0937 0.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2475 -0.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3763 2.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9796 2.8772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1976 2.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0192 2.2112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5979 -0.5344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6044 2.5453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1830 -0.2003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 -2.3190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.5090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.7820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.6290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.8559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 27 1 0 0 0 0 3 27 1 0 0 0 0 4 14 2 0 0 0 0 5 22 1 0 0 0 0 5 27 1 0 0 0 0 10 6 1 6 0 0 0 6 14 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 23 1 0 0 0 0 8 21 2 0 0 0 0 9 18 1 0 0 0 0 9 25 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 19 1 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 17 36 1 0 0 0 0 19 22 2 0 0 0 0 19 37 1 0 0 0 0 20 22 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$