B3LD2U -OEChem-04022101352D 50 52 0 1 0 0 0 0 0999 V2000 7.0868 1.2890 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7778 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1346 -1.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4843 -0.1288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4806 -2.3044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5056 5.6278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7907 4.4666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -2.9731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -4.5826 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.7778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1647 4.1438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6743 -0.7152 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6726 -1.7152 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7238 -0.4045 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7210 -2.0226 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4164 0.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -3.7778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7795 2.2406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4499 2.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.7778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1425 3.9342 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 -3.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8129 4.6762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2262 -0.9976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2255 -1.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1116 -0.3065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1085 -2.1185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0356 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8685 0.2569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0503 -0.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0474 -2.0532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6139 -3.7778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3986 2.7299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2315 1.9505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8307 2.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9978 3.2727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9519 4.5242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -6.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -6.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 4.7338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7491 3.6838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.7409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.8148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9212 6.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 22 1 0 0 0 0 2 26 1 0 0 0 0 2 28 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 14 4 1 1 0 0 0 4 35 1 0 0 0 0 15 5 1 1 0 0 0 5 36 1 0 0 0 0 6 27 1 0 0 0 0 6 50 1 0 0 0 0 7 27 2 0 0 0 0 17 8 1 6 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 20 2 0 0 0 0 9 21 1 0 0 0 0 10 19 2 0 0 0 0 10 26 1 0 0 0 0 11 24 1 0 0 0 0 11 26 2 0 0 0 0 12 24 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 25 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 18 1 6 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 20 37 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 25 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 25 27 1 0 0 0 0 25 42 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END $$$$