B5UA1K -OEChem-04012113083D 44 47 0 0 0 0 0 0 0999 V2000 1.5498 -1.1131 -0.0055 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8767 -2.0334 0.0028 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4247 0.2182 0.0065 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1297 -0.5163 0.0013 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6194 1.0350 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9075 0.7910 -0.0024 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2174 -3.9408 -0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8923 -4.3658 0.3032 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2779 -2.4466 0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9756 -3.1833 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4568 -0.7207 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0223 1.5011 0.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6598 1.8419 0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7613 0.7786 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9516 2.5384 0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2506 3.1867 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5528 3.8782 0.0085 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2008 4.2031 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6816 0.1066 -0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2115 0.2417 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3049 1.0920 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3674 -1.1347 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5905 0.5509 -0.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6531 -1.6758 -0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7646 -0.8330 -0.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -4.0992 -1.3906 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0707 -4.4879 0.1046 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0019 -4.4864 1.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5146 -5.3052 -0.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -1.9223 -0.7532 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7183 -2.2711 0.9916 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1886 -3.1027 0.7562 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5142 -3.2926 -0.9893 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 2.3107 0.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2118 3.4979 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9169 2.0024 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 4.6655 0.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8895 5.2432 0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8644 1.8070 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1806 2.1713 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5622 -1.8537 -0.0082 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 1.2069 -0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7904 -2.7534 -0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7655 -1.2544 -0.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 11 2 0 0 0 0 3 12 1 0 0 0 0 4 11 1 0 0 0 0 4 14 2 0 0 0 0 5 14 1 0 0 0 0 5 19 1 0 0 0 0 5 36 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$