B9E1VS -OEChem-04012120012D 47 49 0 0 0 0 0 0 0999 V2000 2.0000 -0.7095 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 0.8706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 -1.7095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -2.5142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4798 -0.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1477 -1.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 2.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7905 0.6644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8335 0.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5013 -0.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 1.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 0.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1262 -0.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 -1.9809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7654 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4118 2.5655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -0.9048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3403 -0.4411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8474 1.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3087 -1.0816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7301 1.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4409 0.5072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2540 -1.4309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7328 -0.6963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9983 -0.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2477 -1.7883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6444 -2.5702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4263 -2.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2269 3.5176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3514 3.5650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 2.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5397 1.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0185 2.6933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2840 3.1721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7369 -3.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9616 1.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 9 1 0 0 0 0 2 44 1 0 0 0 0 3 21 2 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 4 43 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 12 2 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 26 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 8 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 18 2 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 22 24 2 0 0 0 0 22 45 1 0 0 0 0 23 25 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$