BQN0U5 -OEChem-04022101332D 72 73 0 1 0 0 0 0 0999 V2000 4.2626 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.6466 5.6337 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 3.9526 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 9.0404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 7.5404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3024 8.6822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3703 3.5925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 8.5404 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.2690 9.0404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2690 10.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 9.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 10.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 7.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 6.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 5.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 6.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 4.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8376 7.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6761 3.9526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0945 7.7041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6271 4.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8158 7.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3671 3.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3158 6.3768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3671 3.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2534 8.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3213 3.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4614 9.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9966 8.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0645 3.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 4.8797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.4204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0569 10.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6584 9.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2131 8.4578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6116 9.1481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 11.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 11.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6116 9.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2131 10.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5244 7.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 6.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6116 6.9328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2131 7.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 5.7304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.7304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5196 7.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7659 7.1783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1157 4.6434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3361 4.8091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0679 7.8093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7315 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9324 6.3120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0026 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1245 8.3848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1924 3.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0678 9.8405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5903 10.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8549 10.0983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5817 7.8614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4573 7.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4114 8.7829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6496 2.7717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5252 2.8176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4793 3.6932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1357 4.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6581 5.4862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9228 5.0086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2626 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 72 1 0 0 0 0 2 19 1 0 0 0 0 2 27 1 0 0 0 0 3 20 1 0 0 0 0 3 28 1 0 0 0 0 4 16 1 0 0 0 0 4 49 1 0 0 0 0 5 16 2 0 0 0 0 6 23 1 0 0 0 0 6 29 1 0 0 0 0 7 24 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 35 1 0 0 0 0 10 12 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 13 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 17 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 27 2 0 0 0 0 25 54 1 0 0 0 0 26 28 2 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 29 58 1 0 0 0 0 30 33 1 0 0 0 0 30 34 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 34 71 1 0 0 0 0 M END $$$$