B5M4PQ -OEChem-04012112073D 49 52 0 0 0 0 0 0 0999 V2000 -2.7449 6.2623 -0.1916 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.9593 0.3552 -0.9952 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6864 -2.3177 0.9936 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3389 0.9027 0.2766 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9619 0.7674 0.6119 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4604 -0.1684 1.2345 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9612 -1.6529 0.1775 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5984 -2.0861 -1.3376 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9678 -0.2995 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1473 -0.5554 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9035 2.1601 0.1663 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0208 -1.2702 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3410 -0.4691 -0.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4393 -1.0923 0.9402 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8034 -0.5570 1.6019 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 3.2459 -0.2204 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2584 2.3430 0.4426 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6971 -0.6915 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2823 -2.1189 -0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6873 4.5145 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8278 3.6115 0.3321 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0423 4.6973 -0.0547 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4204 0.3933 -0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1486 -1.3583 -0.8056 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6744 -3.3225 0.5188 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8117 -1.8976 -0.2544 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4487 -1.8164 -1.0193 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9745 -3.7804 0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2408 0.2385 -1.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8617 -3.0274 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2943 -1.0103 -1.7688 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1473 -2.3414 0.2239 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7742 -1.4972 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 0.2083 2.2842 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9383 3.1345 -0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8827 1.5835 0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 0.8247 1.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3953 -2.2701 0.7562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0639 5.3512 -0.6357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8768 3.7466 0.5838 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3566 1.3609 0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9131 -0.4135 -1.2701 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9914 -3.9167 1.1193 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2707 -2.7805 0.0693 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1409 -1.2310 -1.6178 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2962 -4.7234 0.7375 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8198 1.0692 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8739 -3.3840 -0.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9189 -1.1831 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 13 2 0 0 0 0 3 14 2 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 10 2 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 37 1 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 7 38 1 0 0 0 0 8 26 1 0 0 0 0 8 31 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 20 1 0 0 0 0 16 35 1 0 0 0 0 17 21 2 0 0 0 0 17 36 1 0 0 0 0 18 23 1 0 0 0 0 18 26 2 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 23 29 2 0 0 0 0 23 41 1 0 0 0 0 24 27 1 0 0 0 0 24 42 1 0 0 0 0 25 28 2 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 30 2 0 0 0 0 27 45 1 0 0 0 0 28 30 1 0 0 0 0 28 46 1 0 0 0 0 29 31 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 M END $$$$