B3VYO1 -OEChem-04022102302D 45 47 0 1 0 0 0 0 0999 V2000 6.2714 8.6210 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2616 4.9802 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.9593 5.6588 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 7.5633 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5835 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2175 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5835 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.8156 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9496 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6333 6.3019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0050 4.9802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 7.8408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6607 6.7165 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3388 5.7259 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9577 7.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3183 5.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9423 7.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6333 6.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3243 7.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9434 7.8805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 6.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9483 5.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3089 7.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9278 5.7259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2873 6.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9207 8.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 6.7165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5927 7.3516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0835 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9496 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0764 6.2566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9455 5.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4801 7.8192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7181 8.0570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7883 5.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5446 4.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8112 4.3913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6120 5.1067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1207 5.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1467 4.9298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1241 8.0770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 8.6825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.8478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3525 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 4 29 1 0 0 0 0 5 30 1 0 0 0 0 6 30 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 45 1 0 0 0 0 9 31 2 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 19 1 0 0 0 0 14 11 1 1 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 17 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 6 0 0 0 13 32 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 21 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 24 1 0 0 0 0 21 27 2 0 0 0 0 22 26 1 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 23 41 1 0 0 0 0 24 28 2 0 0 0 0 24 42 1 0 0 0 0 25 28 1 0 0 0 0 26 29 2 0 0 0 0 27 29 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 30 31 1 0 0 0 0 M END $$$$