BV4LN5 -OEChem-04042107233D 29 30 0 0 0 0 0 0 0999 V2000 6.1389 -0.1882 -0.0019 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4010 1.8794 -0.0012 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3419 -1.0844 0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1493 -0.4576 0.0014 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 0.6412 -0.0010 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2325 -0.7742 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2955 -1.6772 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4832 0.5981 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8599 0.1639 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5377 -0.3496 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6091 -1.2082 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7968 1.0671 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1371 -1.2632 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7704 -1.0098 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5051 1.0484 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9587 -0.2793 -0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6934 1.7788 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9203 1.1149 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1158 -2.7493 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6758 1.3256 0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4121 -1.9408 -0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9546 2.1427 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2726 -2.3611 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8153 -2.0961 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5681 1.5993 0.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4019 -2.0965 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9139 -0.7962 -0.0044 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6641 2.8646 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8455 1.6837 -0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 2 5 2 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 26 1 0 0 0 0 4 13 2 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 7 11 1 0 0 0 0 7 19 1 0 0 0 0 8 12 2 0 0 0 0 8 20 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 M CHG 2 1 -1 5 1 M END $$$$