BTQK89 -OEChem-04022103352D 40 43 0 0 0 0 0 0 0999 V2000 6.2619 -1.0495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 1.5307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.8542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5118 1.3588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3056 2.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6449 0.8603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3113 2.4435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 1.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 0.3739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.9120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 0.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.7058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7630 0.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1018 1.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9223 2.4010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3067 2.9573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1835 0.4462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0085 0.3580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4412 3.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 2.6361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 -0.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 2.6581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -0.4216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 2.3240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5749 1.1673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -2.4435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 31 1 0 0 0 0 10 13 2 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 19 2 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 19 21 1 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 22 2 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$