L9Y4NI -OEChem-05022323472D 53 57 0 0 0 0 0 0 0999 V2000 2.0000 0.3923 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.4478 1.7195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2754 0.7013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 1.6284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1132 2.5794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9478 0.8535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4793 -0.4594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 -1.9594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3453 -1.9594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3733 1.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1165 1.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5812 0.3412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0675 1.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5323 0.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2265 0.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 1.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1132 2.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 1.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9696 1.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8532 1.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8651 2.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 0.3412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 1.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7786 2.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7472 -1.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4793 -1.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 0.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 1.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.7013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2444 1.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4075 2.5359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 2.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9616 0.3196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4949 -0.2728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6871 1.7011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1538 2.2934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2412 -0.5152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0209 -0.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9354 -0.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7151 0.0106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4777 3.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3282 2.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 -0.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -0.0737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2389 2.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9076 3.0691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 -1.7694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5653 -0.5743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6982 2.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3453 -2.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8822 -1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 6 1 0 0 0 0 2 26 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 10 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 17 2 0 0 0 0 5 18 1 0 0 0 0 6 19 2 0 0 0 0 7 20 2 0 0 0 0 7 28 1 0 0 0 0 8 27 1 0 0 0 0 8 28 2 0 0 0 0 9 28 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 19 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 18 2 0 0 0 0 16 20 1 0 0 0 0 17 43 1 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 2 0 0 0 0 22 44 1 0 0 0 0 23 27 2 0 0 0 0 23 45 1 0 0 0 0 24 29 1 0 0 0 0 24 46 1 0 0 0 0 25 30 2 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 29 31 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 M END $$$$