LABN84 -OEChem-05032300552D 64 68 0 1 0 0 0 0 0999 V2000 2.0000 0.2489 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2788 -3.2432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0687 -3.2152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -3.2152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -1.4831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0687 -1.4831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4851 -2.2878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.3491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5687 -2.3491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5687 -0.6171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0687 -1.4831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0427 4.0812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5878 -0.6741 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5388 -0.9831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4851 -0.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5388 -1.9831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7957 0.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5878 -2.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2788 0.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7742 0.4784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0687 -1.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9479 1.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3006 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -0.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6389 1.9712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9916 1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5687 -2.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5687 -0.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6607 2.1791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0687 -1.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3517 3.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5687 -4.0812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5687 -2.3491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5687 -0.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9754 -0.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9883 0.8615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9021 -0.1283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3809 0.6062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6464 1.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5894 1.4305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7138 1.4779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6664 0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5544 0.8912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8858 0.0241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -0.0802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0537 2.4319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3852 1.5648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2587 -0.0802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -2.8861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.4831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0317 -4.3912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8787 -4.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1056 -3.7712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0317 -2.6591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8787 -2.8861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1056 -2.0391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1056 -0.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8787 -0.0802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0317 -0.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 2 18 2 0 0 0 0 3 30 1 0 0 0 0 3 37 1 0 0 0 0 4 26 2 0 0 0 0 5 13 1 0 0 0 0 5 18 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 23 1 0 0 0 0 7 16 2 0 0 0 0 8 26 1 0 0 0 0 8 34 1 0 0 0 0 8 54 1 0 0 0 0 9 30 2 0 0 0 0 9 35 1 0 0 0 0 10 31 1 0 0 0 0 10 35 2 0 0 0 0 11 35 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 36 3 0 0 0 0 13 14 1 0 0 0 0 13 19 1 1 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 17 41 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 26 1 0 0 0 0 20 27 2 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 30 1 0 0 0 0 23 31 2 0 0 0 0 24 28 1 0 0 0 0 24 48 1 0 0 0 0 25 29 2 0 0 0 0 25 49 1 0 0 0 0 27 33 1 0 0 0 0 27 50 1 0 0 0 0 28 32 2 0 0 0 0 28 51 1 0 0 0 0 29 32 1 0 0 0 0 29 52 1 0 0 0 0 31 53 1 0 0 0 0 32 36 1 0 0 0 0 33 34 2 0 0 0 0 34 55 1 0 0 0 0 37 56 1 0 0 0 0 37 57 1 0 0 0 0 37 58 1 0 0 0 0 38 59 1 0 0 0 0 38 60 1 0 0 0 0 38 61 1 0 0 0 0 39 62 1 0 0 0 0 39 63 1 0 0 0 0 39 64 1 0 0 0 0 M END $$$$