L2RQB3 -OEChem-05022322482D 43 45 0 0 0 0 0 0 0999 V2000 6.5620 -1.9932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8512 -3.1499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.2012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 3.0059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4975 -2.6118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 1.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 0.4459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9192 -0.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5655 0.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2298 -1.2489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2083 -1.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8762 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5190 -2.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5835 -1.7870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4800 2.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.8212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 3.0112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -0.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.7381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.8912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.6642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 2.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 2.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9796 0.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4828 -0.8387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7113 -1.1803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9768 -1.6591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4556 -2.3936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6901 -3.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9116 -2.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 24 1 0 0 0 0 2 23 2 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 26 1 0 0 0 0 5 12 2 0 0 0 0 6 11 2 0 0 0 0 6 13 1 0 0 0 0 7 23 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 9 25 1 0 0 0 0 10 16 2 0 0 0 0 10 19 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 22 2 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$