B4W3NC -OEChem-04012116312D 33 35 0 0 0 0 0 0 0999 V2000 2.0000 -1.4849 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -3.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1871 0.0147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -2.4849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0761 3.2787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -1.6802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8335 -0.5234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -0.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -2.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 0.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4763 1.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 0.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7654 2.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 2.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 1.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0546 3.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2475 -0.9849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8696 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5367 0.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3729 2.5834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0400 1.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1825 2.8782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6613 3.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9268 4.0916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 19 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 11 1 0 0 0 0 7 14 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 13 1 0 0 0 0 10 15 2 0 0 0 0 10 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 26 1 0 0 0 0 17 20 1 0 0 0 0 17 27 1 0 0 0 0 18 21 2 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 22 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 M END $$$$