L9FVB6 -OEChem-05022322463D 41 44 0 0 0 0 0 0 0999 V2000 -3.1907 -1.3180 -0.6283 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5582 1.3898 0.2261 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 -1.0253 -1.3223 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0369 -2.5791 0.0713 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3165 -0.6306 0.3239 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8744 -1.0793 -1.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4646 0.1384 -0.6865 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0252 -0.9702 -0.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3403 1.1910 -0.6415 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1888 0.1939 -1.2371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5715 0.7092 0.0211 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5494 -1.0063 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3138 -2.1511 -0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2092 -1.5520 0.9802 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0153 -2.1610 -0.5896 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9897 2.4181 -1.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1862 1.4433 -1.7755 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7107 2.5369 -1.7339 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0282 -1.5242 2.4838 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9393 -0.0158 0.5437 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5289 1.2152 0.3196 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1584 -0.2555 1.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3304 2.2417 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9601 0.7710 2.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5461 2.0196 2.3747 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -3.0496 0.3961 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2359 -1.2485 0.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -2.5623 0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5443 -3.0931 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 3.2643 -1.1372 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1646 1.5881 -2.2257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0579 -0.4689 -2.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4014 3.4914 -2.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2009 -0.5192 2.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0136 -1.8243 2.7661 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7328 -2.2090 2.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1349 1.4108 -0.5594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -1.2198 1.8423 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7844 3.2147 1.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 0.5983 3.4642 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3907 2.8191 3.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 20 1 0 0 0 0 2 11 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 12 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 16 2 0 0 0 0 10 12 2 0 0 0 0 10 17 1 0 0 0 0 12 15 1 0 0 0 0 13 15 2 0 0 0 0 13 26 1 0 0 0 0 14 19 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 25 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$