B3KLZ6 -OEChem-04012114012D 68 72 0 1 0 0 0 0 0999 V2000 9.3914 3.0784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9737 2.3739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.9920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.9920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.4920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.4920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1603 0.5469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.9920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1603 0.5469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.4920 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3301 0.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2053 1.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4982 0.7492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2394 1.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8512 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4693 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5725 1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9792 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7982 3.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.1820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 0.4004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 1.0906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8042 2.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0448 2.5728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8993 0.5887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6586 0.1503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0789 2.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6405 1.5547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -1.8843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -2.5746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -0.0170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -0.0170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -2.9669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -2.9669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -1.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -0.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -4.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2616 -0.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0589 -0.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -2.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.3720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0585 1.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1418 0.9099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3646 3.7398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0503 4.5584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2318 4.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 36 2 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 12 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 5 22 1 0 0 0 0 6 22 2 0 0 0 0 6 31 1 0 0 0 0 7 30 1 0 0 0 0 7 31 2 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 35 1 0 0 0 0 9 30 1 0 0 0 0 9 62 1 0 0 0 0 9 63 1 0 0 0 0 10 34 2 0 0 0 0 11 33 3 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 21 23 1 0 0 0 0 21 24 2 0 0 0 0 22 25 1 0 0 0 0 23 26 2 0 0 0 0 23 55 1 0 0 0 0 24 27 1 0 0 0 0 24 56 1 0 0 0 0 25 29 1 0 0 0 0 25 30 2 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 29 32 2 0 0 0 0 29 34 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 M END $$$$