BJD4B1 -OEChem-04042102433D 44 46 0 1 0 0 0 0 0999 V2000 -0.8409 0.7604 1.0707 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1672 -2.2962 -1.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1266 1.3169 -0.8857 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1791 -0.7809 0.0046 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7383 -1.7074 1.7269 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5312 -0.9441 0.0879 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5525 -1.6272 -0.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0718 -1.8339 0.3215 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -0.9471 1.1268 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5039 1.4236 0.5565 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0648 0.3229 -0.3694 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7545 -2.0007 0.2937 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9223 -1.8735 -0.7049 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3284 1.6678 1.8277 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3029 2.7387 -0.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5548 0.1959 -0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7054 -1.5109 0.5134 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9366 -1.1312 -0.2944 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1257 0.3680 -0.3247 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5344 1.1051 -1.3373 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 0.9753 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7086 2.4888 -1.3654 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0601 2.3591 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9825 -2.1852 -0.5041 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4714 3.1157 -0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8722 -1.2813 2.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7316 0.4582 -1.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7191 -2.9924 0.7604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8182 2.3594 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2981 2.1197 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5265 0.7412 2.3781 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8178 3.4935 0.4316 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6843 2.6041 -1.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2606 3.1587 -0.5241 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6311 -1.4398 -1.2618 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7937 -1.4975 -1.3216 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1054 1.2536 -0.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9373 0.6276 -2.1086 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3428 0.4118 1.4688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 3.0781 -2.1536 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 2.8481 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8731 -2.7205 -0.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9457 -1.9824 -1.5879 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6058 4.1932 -0.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 13 2 0 0 0 0 3 16 1 0 0 0 0 3 37 1 0 0 0 0 4 16 2 0 0 0 0 5 17 2 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 7 12 1 0 0 0 0 7 17 1 0 0 0 0 7 35 1 0 0 0 0 8 18 1 0 0 0 0 8 24 2 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 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 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 25 2 0 0 0 0 22 40 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$