BV1YD3 -OEChem-04012112322D 47 49 0 0 0 0 0 0 0999 V2000 5.8301 -2.5522 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.9182 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -4.2842 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 2.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 4.0763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 3.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 4.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9441 3.4195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0677 2.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8792 2.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5038 4.6929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9486 4.0763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4616 2.9574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5484 3.7826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 4.5364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3552 4.8739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.3918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.2282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.7282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.7982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.6187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.7718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.5449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.2282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 25 1 0 0 0 0 3 25 1 0 0 0 0 4 8 1 0 0 0 0 4 13 1 0 0 0 0 5 14 1 0 0 0 0 5 22 1 0 0 0 0 6 19 2 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 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 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 26 1 0 0 0 0 23 41 1 0 0 0 0 24 27 1 0 0 0 0 24 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END $$$$