BJAQ93 -OEChem-04042101583D 66 69 0 0 0 0 0 0 0999 V2000 -0.5578 -1.0283 -0.1948 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2382 -2.7586 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 0.4041 -0.1521 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6869 1.3013 -0.0521 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4928 0.9068 -0.0421 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2082 -1.4118 -0.1855 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5271 -4.8652 0.4469 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9107 0.4824 -0.1622 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7404 1.5040 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9148 0.9538 1.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 1.0997 -1.3191 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3908 0.8319 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3652 0.9817 -1.3519 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5535 -0.2966 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5314 0.2261 1.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9572 -1.6394 -1.7541 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5137 -1.1959 1.7873 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6638 -2.7036 -0.7036 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4814 -2.1492 1.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8393 -3.1695 0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 2.4219 0.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2096 0.0079 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9469 2.1921 0.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7169 -0.1322 -0.1142 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0913 3.7409 0.1028 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8305 3.2784 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9802 4.8146 0.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3505 4.5840 0.1818 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6098 -1.6904 -0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8597 -3.1542 0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3289 -3.5369 0.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1785 1.5354 -0.3496 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0291 2.5497 0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2416 0.3874 1.9777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2038 2.0047 1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1681 2.1624 -1.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2655 0.6830 -2.2587 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -0.2313 1.2237 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0193 1.2951 2.0741 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9758 1.5517 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -0.0656 -1.5469 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5293 0.3473 -2.2143 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6244 -0.4240 -1.1289 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 0.5157 1.1412 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 0.9309 1.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6388 -2.0752 -2.4971 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0252 -1.4554 -2.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4994 -1.6002 1.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8514 -1.1145 2.8298 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 -3.5841 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -2.3773 -0.0663 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0145 -2.7226 1.8547 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2697 -1.5994 0.5594 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6169 -3.5913 -0.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4806 -4.0056 0.7614 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0467 4.0215 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9049 3.1087 0.1095 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6009 5.8309 0.2378 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5636 -2.1931 -0.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0443 5.4171 0.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1322 -1.0667 0.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0339 -1.4548 -1.1684 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3335 -3.7995 -0.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4594 -3.3795 1.1517 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4605 -5.2623 0.4689 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7592 -5.4920 0.6652 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 2 0 0 0 0 2 31 2 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 2 0 0 0 0 6 24 1 0 0 0 0 6 29 1 0 0 0 0 6 59 1 0 0 0 0 7 31 1 0 0 0 0 7 65 1 0 0 0 0 7 66 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 32 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 16 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 17 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 18 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 19 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 20 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 23 1 0 0 0 0 21 25 2 0 0 0 0 22 24 1 0 0 0 0 23 26 2 0 0 0 0 25 27 1 0 0 0 0 25 56 1 0 0 0 0 26 28 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 58 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 M END $$$$