D0R3DP -OEChem-10101305022D 52 52 0 1 0 0 0 0 0999 V2000 5.4641 -1.1091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5661 -0.3085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 1.3388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 0.9787 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0981 1.9297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 1.9297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 0.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1091 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3582 0.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0524 1.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7955 1.6989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 1.3899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4897 2.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4408 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1839 2.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5041 0.3663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7045 2.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0333 2.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 2.5463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 2.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2227 1.2308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4791 0.4417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9724 1.9452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7613 0.4823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5409 0.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0866 2.2463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3069 2.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.5722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.4191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 0.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.4191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.4191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4555 0.8424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2351 1.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7808 2.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0011 2.4407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1497 1.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9293 1.3683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5988 1.9584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6446 2.8340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7690 2.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 12 2 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 4 31 1 0 0 0 0 11 5 1 1 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 1 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 M END $$$$