BVPQ15 -OEChem-04022105243D 50 53 0 0 0 0 0 0 0999 V2000 -2.1898 -1.4541 1.5524 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3373 0.4044 0.4337 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4882 -0.0888 0.7796 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6968 0.2181 0.0138 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4197 -1.3383 -1.0392 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3899 1.5136 0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8495 -0.8937 0.9025 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 1.0208 -0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5058 -0.7600 1.6114 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6976 0.5938 0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5087 -0.4380 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8378 -0.5126 0.8385 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2706 1.8412 0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8637 -0.1810 -0.5425 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2723 -1.7884 -0.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 2.0689 0.2338 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4502 1.0610 -0.2748 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -2.3153 -1.1394 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0934 0.0441 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9081 1.1135 -0.5256 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6512 -1.2165 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2804 0.9222 -0.6851 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8382 -0.3385 -0.4725 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0236 -1.4078 -0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3376 2.4747 -0.7598 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3056 -0.5434 -0.6431 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7048 2.2372 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3469 2.0375 1.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6764 -1.5447 0.0411 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5607 -1.3668 1.5893 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6899 1.8714 0.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0205 0.6703 -1.0857 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1479 -1.7487 1.9166 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6136 -0.1587 2.5225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6846 2.6584 0.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3572 -2.3570 -0.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0517 3.0441 0.4565 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5055 1.2391 -0.4527 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 1.0766 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3915 -1.4494 -1.2936 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7202 -3.2960 -1.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0537 -2.0868 0.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9204 1.7527 -0.9739 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4456 -2.3964 0.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7968 2.8253 0.1256 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 3.2126 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6615 2.4639 -1.6211 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8274 -0.3186 0.2924 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5315 -1.5760 -0.9302 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7041 0.1026 -1.4327 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 12 1 0 0 0 0 4 19 1 0 0 0 0 4 39 1 0 0 0 0 5 14 1 0 0 0 0 5 18 1 0 0 0 0 5 40 1 0 0 0 0 6 8 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 13 16 1 0 0 0 0 13 35 1 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 21 24 2 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END $$$$