L5DFC3 -OEChem-05022321363D 65 68 0 0 0 0 0 0 0999 V2000 -3.9418 -0.3188 -1.2513 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7874 -5.0038 -2.5812 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 3.9984 -1.2428 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3181 -0.2516 -0.7949 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3816 2.5648 1.3008 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5266 1.3893 -0.5778 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9415 2.2523 -0.3561 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5922 -0.8530 1.4579 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8774 -3.4086 -0.6522 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4002 0.4562 1.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8283 -2.6563 -1.8796 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8964 2.5935 -0.0189 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9426 1.6519 -0.8705 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6539 3.4825 -0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0653 3.7620 -0.9856 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0639 2.8434 -1.8162 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3869 0.2583 0.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7012 4.6691 -0.2804 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1796 3.4602 1.3448 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8268 3.6071 -1.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9779 -0.3005 0.2383 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8668 -1.3162 -0.0833 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2269 0.5796 0.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8068 1.8364 0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1316 -0.0624 0.5523 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8881 -2.2960 0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1463 -2.1851 1.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7923 -1.5663 -1.0882 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -1.4712 1.7744 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3617 -1.5770 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0719 -2.6876 2.4013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1409 -1.9736 3.0572 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9254 -2.5820 3.3706 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8376 -3.5189 -1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0117 -5.3765 -2.5921 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8258 2.4334 0.1508 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3564 2.8525 0.9438 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4885 1.8641 0.0581 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4034 0.7776 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 4.6735 -0.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 3.5828 -1.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 2.6335 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1195 3.0779 -1.9867 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6509 0.5328 1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -0.5660 0.0368 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 1.6485 -1.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 5.6174 -0.2087 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2223 4.6386 -1.2663 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9053 4.7124 0.4684 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8325 4.3216 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7679 2.5549 1.5356 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3903 3.5030 2.1004 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3929 4.5299 -0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5197 2.7640 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4757 3.6122 -2.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2619 -0.8243 2.2236 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -1.2066 -0.2051 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -3.1644 2.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9093 -1.8975 3.8222 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7554 -2.9729 4.3695 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 1.3525 1.9931 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 0.0056 1.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5579 -4.5197 -2.9623 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3339 -5.6417 -1.5894 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1697 -6.2268 -3.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 28 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 21 2 0 0 0 0 5 24 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 7 14 1 0 0 0 0 7 24 1 0 0 0 0 7 46 1 0 0 0 0 8 21 1 0 0 0 0 8 29 1 0 0 0 0 8 56 1 0 0 0 0 9 26 1 0 0 0 0 9 34 2 0 0 0 0 10 25 1 0 0 0 0 10 61 1 0 0 0 0 10 62 1 0 0 0 0 11 28 2 0 0 0 0 11 34 1 0 0 0 0 12 15 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 16 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 21 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 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 20 55 1 0 0 0 0 22 25 1 0 0 0 0 22 26 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 26 27 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 29 30 1 0 0 0 0 29 32 2 0 0 0 0 30 57 1 0 0 0 0 31 33 2 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 M END $$$$