D0R5RF -OEChem-10101305022D 43 46 0 1 0 0 0 0 0999 V2000 5.3548 2.1061 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7485 -1.4874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7523 0.6882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.9608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4026 -0.3955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.7656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.2056 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9405 -0.8982 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9422 0.1018 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6783 -2.1561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6844 1.3641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0474 3.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7178 3.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0696 3.2672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4104 4.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7622 4.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4327 4.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5889 -1.8076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 0.5105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4934 -0.6177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 -0.1806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7826 -0.3945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3035 1.8533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1364 1.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -2.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3154 -1.2362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3182 0.4350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -4.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 3.6697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 2.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8261 5.2112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 4.3488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2421 5.5508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 11 2 1 1 0 0 0 2 34 1 0 0 0 0 12 3 1 1 0 0 0 3 35 1 0 0 0 0 4 18 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 30 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 36 1 0 0 0 0 7 15 1 0 0 0 0 7 20 1 0 0 0 0 7 37 1 0 0 0 0 8 18 1 0 0 0 0 8 20 2 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 26 1 1 0 0 0 10 12 1 0 0 0 0 10 14 1 6 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$