L1KNE7 -OEChem-05032300063D 53 56 0 1 0 0 0 0 0999 V2000 -6.1076 -1.5582 0.3226 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9041 -2.5092 0.9982 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3242 1.1425 0.9721 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8742 -1.1042 0.6795 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 1.8637 0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2419 3.9583 -1.1624 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6867 2.6402 -0.9395 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -3.5737 -2.2718 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6377 -1.3122 0.0294 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8548 -0.1960 1.3763 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0321 -0.1875 1.8189 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7488 -0.4569 2.6033 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7585 1.2432 1.3002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4399 -1.2069 0.3735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 2.0771 0.2588 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9247 -1.6897 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5369 -2.5275 -1.1846 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3019 3.1912 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5559 4.1076 -0.8947 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3121 2.8302 -0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7331 -3.1058 -1.7834 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5864 1.6115 -0.6037 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1275 0.3024 -0.4577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9378 1.9019 -0.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0201 -0.7163 -0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8303 0.8832 -0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3715 -0.4260 0.0629 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -1.4885 0.4093 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6751 -2.2866 0.2804 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6411 -3.4077 -0.7376 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7812 -0.2760 1.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9787 -0.3118 2.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5863 0.2531 3.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6696 -1.4842 2.9746 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3793 1.4548 0.4226 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9255 1.9911 2.0828 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2526 -0.9461 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1136 -2.2322 0.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0208 -1.8963 -1.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8546 -3.3205 -0.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3499 3.3888 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0067 5.0158 -1.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 3.4599 -1.3539 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0947 0.0232 -0.6377 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3061 2.9195 -0.5197 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6452 -1.7322 -0.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8674 1.1587 0.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9089 -0.4990 -0.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6355 -1.7633 0.2407 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 -2.6908 1.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6903 -3.9494 -0.7029 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -3.0174 -1.7534 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4474 -4.1222 -0.5452 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 28 2 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 3 15 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 4 16 1 0 0 0 0 5 15 2 0 0 0 0 5 20 1 0 0 0 0 6 19 1 0 0 0 0 6 20 2 0 0 0 0 7 20 1 0 0 0 0 7 22 1 0 0 0 0 7 43 1 0 0 0 0 8 21 3 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 48 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 21 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 45 1 0 0 0 0 25 27 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END $$$$