B5MCZ3 -OEChem-04012115373D 40 42 0 1 0 0 0 0 0999 V2000 3.1263 2.7366 0.3852 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4396 -0.9008 -0.2718 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2848 1.4920 -0.2073 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5276 -1.9779 -0.0193 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9401 -0.2016 0.2862 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4788 -0.0789 0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 0.2653 -0.7709 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7451 0.1448 -0.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5361 -1.4754 -0.3894 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7233 1.0316 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3357 -0.3079 1.7965 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 0.0232 -1.2988 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5709 -0.0692 1.0733 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6532 0.1349 -1.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 0.0426 0.8187 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -0.8256 -0.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4328 0.4171 0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6229 1.6566 0.0942 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8129 0.4787 0.2867 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5475 -0.6974 0.3269 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8639 -1.8887 0.1732 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9096 0.3341 -1.8525 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0263 -2.3789 -0.0346 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4348 -1.4456 -1.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6041 -1.5822 -0.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6274 1.1271 -1.3491 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3499 1.9601 0.1858 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7936 0.9562 -0.0374 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8915 -1.1929 2.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0221 0.5804 2.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4227 -0.3940 1.9148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7048 0.0175 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8725 -0.1457 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3107 0.2133 -2.5816 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5091 0.0498 1.6545 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0401 -1.8231 -0.4022 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 2.3235 -0.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3246 1.4277 0.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6202 -0.6823 0.4809 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3885 -2.8381 0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 2 36 1 0 0 0 0 3 7 1 0 0 0 0 3 18 1 0 0 0 0 3 37 1 0 0 0 0 4 16 1 0 0 0 0 4 21 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 12 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 15 2 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$