BL6NQ1 -OEChem-04022109162D 46 50 0 1 0 0 0 0 0999 V2000 3.2579 -4.7617 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5397 -3.0021 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9695 0.7199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2314 0.2199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2425 2.4752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9103 -1.7796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7533 4.2584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8776 1.7617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4994 1.2199 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0174 3.2650 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -1.2415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4994 0.2199 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5531 -0.0848 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3654 -0.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3654 1.7199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2314 1.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5531 1.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2425 -1.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3493 2.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1414 1.7268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1494 2.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2474 3.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0212 4.2650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8815 2.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8892 4.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7494 3.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9533 -2.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0017 -2.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9505 -3.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4094 -0.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9407 -0.1810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9669 -0.7550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7639 -0.7550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8088 3.0652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6747 1.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 3.9092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8114 4.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4103 4.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8499 -0.7801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2896 5.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4925 5.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9592 2.6749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3604 3.3637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5008 -2.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4978 -3.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 27 1 0 0 0 0 2 30 1 0 0 0 0 3 13 1 0 0 0 0 3 17 1 0 0 0 0 4 14 1 0 0 0 0 4 16 1 0 0 0 0 5 17 2 0 0 0 0 6 18 2 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 24 2 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 9 17 1 0 0 0 0 10 21 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 18 1 0 0 0 0 11 27 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 6 0 0 0 13 18 1 6 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 19 22 2 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 37 1 0 0 0 0 23 25 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 M END $$$$