LBVM82 -OEChem-05022323022D 37 39 0 0 0 0 0 0 0999 V2000 6.4021 -4.2428 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.6381 -1.9422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 -0.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 2.0186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1733 -0.2949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 2.7231 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 3.7412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -1.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4791 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 0.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 0.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -2.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -2.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -3.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 -0.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -3.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -4.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 2.8276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2714 -0.8466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 0.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -2.4328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2671 -4.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -1.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4011 -1.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -2.7797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -4.8628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 0.4342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7630 -0.4865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0444 0.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 1.7448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4436 4.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4246 3.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 17 2 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 3 24 1 0 0 0 0 4 15 2 0 0 0 0 4 23 1 0 0 0 0 5 17 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 22 1 0 0 0 0 6 23 2 0 0 0 0 7 23 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 25 1 0 0 0 0 13 16 1 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 14 26 1 0 0 0 0 15 21 1 0 0 0 0 16 20 2 0 0 0 0 16 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$