B3YN4R -OEChem-04012113223D 51 53 0 0 0 0 0 0 0999 V2000 6.8144 2.2950 0.0911 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8718 -3.5490 -0.1544 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9507 3.5953 0.1408 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8569 -2.4024 -0.0933 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3191 0.0011 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7815 0.0016 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8388 -0.7740 1.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8380 -0.6793 -1.2865 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9448 1.4134 0.0516 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1294 -1.2051 -0.0467 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 1.2092 0.0465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 0.0031 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7346 -1.2042 -0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7361 1.2099 0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 0.0044 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1987 0.0056 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 -1.0639 0.5653 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8941 1.0734 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6456 0.0063 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5015 -1.0633 0.5654 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5008 1.0740 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3435 -1.2004 -0.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3429 1.2136 0.0479 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7384 -1.2001 -0.0459 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7379 1.2142 0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4357 0.0071 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4661 -2.4583 -0.0952 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4647 2.4728 0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9341 -0.7526 1.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5422 -1.8284 1.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4585 -0.3373 2.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5427 -1.7322 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9332 -0.6534 -1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4561 -0.1746 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0404 1.3533 0.0475 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6655 1.9524 0.9645 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6624 2.0203 -0.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6505 -2.1553 -0.0899 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6216 2.1731 0.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2342 -2.1664 -0.1131 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2362 2.1723 0.1161 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3933 -1.8991 1.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3948 1.9080 -1.0444 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0013 -1.8977 1.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.9089 -1.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8202 -2.1505 -0.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 2.1657 0.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5166 0.0351 0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 -1.5668 -0.0513 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3852 -3.2686 -0.1345 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2951 3.1495 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 51 1 0 0 0 0 2 27 2 0 0 0 0 3 28 2 0 0 0 0 4 27 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 13 1 0 0 0 0 10 38 1 0 0 0 0 11 14 2 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 20 1 0 0 0 0 17 42 1 0 0 0 0 18 21 2 0 0 0 0 18 43 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 24 1 0 0 0 0 22 46 1 0 0 0 0 23 25 2 0 0 0 0 23 47 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$