BOV3I2 -OEChem-04022102032D 52 55 0 1 0 0 0 0 0999 V2000 7.1279 -4.8400 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8400 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.8400 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.9581 5.8400 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2686 -2.2747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6146 -3.3666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6183 -1.1910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2208 0.2269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9356 1.3881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -4.0352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -5.6447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5616 1.7108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8066 -2.7774 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8083 -1.7774 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8550 -3.0847 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8578 -1.4667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5504 -0.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -4.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9134 1.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5838 1.9204 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 -4.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.3400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2765 2.8720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9469 3.6140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6395 4.5656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9247 3.4044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3099 5.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5951 4.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2877 5.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7085 -3.3896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3602 -2.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2926 -3.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2456 -1.3686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1695 -0.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0025 -0.8052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1814 -3.1154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1843 -1.4441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9995 2.3805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8956 3.3613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7286 2.5819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 1.1209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9773 2.1709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0333 4.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1152 2.8144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1194 5.8976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2013 4.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 4 33 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 13 6 1 1 0 0 0 6 40 1 0 0 0 0 14 7 1 1 0 0 0 7 41 1 0 0 0 0 8 17 1 0 0 0 0 8 22 1 0 0 0 0 9 22 2 0 0 0 0 10 15 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 19 2 0 0 0 0 11 20 1 0 0 0 0 24 12 1 6 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 6 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 20 23 2 0 0 0 0 21 25 1 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 23 26 1 0 0 0 0 23 43 1 0 0 0 0 24 27 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 49 1 0 0 0 0 30 32 2 0 0 0 0 30 50 1 0 0 0 0 31 33 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 M END $$$$