BOU4T6 -OEChem-04022106382D 59 62 0 1 0 0 0 0 0999 V2000 8.5292 1.1406 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1343 -2.7215 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5586 3.6351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2208 -3.1283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0478 -2.3148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8977 -0.2945 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.7166 -2.0170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6926 2.1351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0074 1.7987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3099 -1.1035 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0349 1.6780 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2937 2.6439 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9848 1.3715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5571 3.6265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8138 0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2604 2.3328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4338 1.1692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 0.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5586 2.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4247 2.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3382 2.5418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5074 0.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5461 3.5200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9141 0.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9086 -0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3263 -0.7899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3153 -0.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7330 -1.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7276 -1.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5410 -3.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 3.1419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8749 4.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9439 3.7185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 0.3436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2305 0.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2554 2.9528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6461 2.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2389 0.5806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0278 0.9914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1772 0.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6156 0.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3749 0.5516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1077 2.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 1.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8923 0.9346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8671 1.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9435 0.1305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 0.2069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1526 3.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6750 4.1264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9397 3.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 0.4162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7097 -0.7251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3686 -2.2050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9746 -3.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7932 -4.2015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1074 -3.3829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 24 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 21 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 12 1 0 0 0 0 8 17 1 0 0 0 0 8 21 1 0 0 0 0 9 23 1 0 0 0 0 9 24 2 0 0 0 0 10 29 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 17 1 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 54 1 0 0 0 0 28 30 2 0 0 0 0 28 55 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$