B95IUG -OEChem-04022106453D 31 33 0 0 0 0 0 0 0999 V2000 -6.8480 -0.4176 0.0132 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6043 2.9497 0.1323 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2168 2.0468 -0.5947 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2285 0.6231 0.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9717 0.2514 -0.2698 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0448 -0.5127 0.2837 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1496 0.5865 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3204 -0.1435 -0.1384 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9231 1.7803 0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 1.3119 -0.2588 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -1.8439 0.4899 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3288 -1.0540 -0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 0.0952 -0.2036 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7376 -2.7912 0.2602 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0222 -2.3999 -0.1666 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0347 0.2605 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0925 -0.2331 -1.3513 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4191 0.1031 1.0796 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4768 -0.3904 -1.2847 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1401 -0.2223 -0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2502 -0.1406 1.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.5792 1.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7498 -2.1634 0.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5194 0.1303 -1.1686 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3149 -0.7480 -0.7002 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -3.8463 0.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7822 -3.1579 -0.3371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5129 0.5157 1.9315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5909 -0.3680 -2.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9232 0.2372 2.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0258 -0.6443 -2.1878 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 9 2 0 0 0 0 3 10 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 24 1 0 0 0 0 6 8 1 0 0 0 0 6 11 2 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 17 19 2 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 M END $$$$