BNIA05 -OEChem-04022107462D 50 53 0 1 0 0 0 0 0999 V2000 2.0000 -1.3067 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.1137 -2.8005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7403 2.8034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5142 1.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4602 -0.2934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9961 -1.2659 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -0.2451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9961 -0.2659 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8622 0.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -1.7659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1022 0.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -1.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -0.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1022 -1.8005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8461 1.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -1.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6382 0.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7441 1.8034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6462 1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 -1.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8723 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -1.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3782 1.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6038 -2.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.8034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 -3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 -2.8034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0009 0.3541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4636 -2.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2607 -2.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5068 0.7386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7086 0.7478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9402 -1.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3388 -1.1582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6604 0.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3056 1.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1715 -0.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3344 -2.4100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1803 3.8382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3342 3.6080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5644 2.7619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0662 0.7402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9140 0.9638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6903 1.8116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7296 -0.6801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -3.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7421 -3.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3361 -3.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 14 2 0 0 0 0 3 18 1 0 0 0 0 3 22 1 0 0 0 0 4 19 1 0 0 0 0 4 24 1 0 0 0 0 5 21 2 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 11 1 0 0 0 0 7 16 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 30 1 0 0 0 0 9 13 1 0 0 0 0 9 15 2 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 17 2 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 38 1 0 0 0 0 16 20 2 0 0 0 0 17 19 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 28 2 0 0 0 0 26 48 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END $$$$