L4I7RT -OEChem-05022323353D 41 44 0 0 0 0 0 0 0999 V2000 4.7495 2.3444 1.8513 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9516 1.2242 -1.7001 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2544 1.1861 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1986 3.3928 -0.2453 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6217 -0.2850 -0.9304 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5391 -0.4770 -0.1933 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1811 0.5671 0.7799 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8638 -3.7756 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5101 -4.1335 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7254 -4.2741 -1.1327 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -2.3854 0.4889 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7429 0.1386 0.8711 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4364 -1.2266 0.6644 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4249 1.3529 -0.9533 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6783 2.4268 0.4877 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 0.2529 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5605 0.5812 1.8449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4063 2.7227 -1.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6659 0.2513 -1.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -0.2597 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6412 -1.0941 0.8647 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5666 0.7890 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -0.8798 1.0643 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9304 1.0033 -0.4474 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6496 0.1689 0.4082 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0465 0.3887 0.6133 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2961 -4.4655 0.9946 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8076 -3.3472 -0.5104 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0453 -5.0416 0.1004 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0758 -5.2760 -1.3503 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8401 -3.5753 -1.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4371 -0.5723 -1.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3861 0.6087 -2.6334 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0719 -0.0356 2.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 3.2629 -1.9177 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 -1.0708 -0.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1403 -1.2602 0.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1509 -1.9149 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0786 1.4762 -1.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 -1.5387 1.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 1.8248 -0.9653 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 19 2 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 15 2 0 0 0 0 4 18 1 0 0 0 0 5 16 1 0 0 0 0 5 19 1 0 0 0 0 5 36 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 6 37 1 0 0 0 0 7 26 3 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 3 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 14 16 1 0 0 0 0 14 18 2 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 M END $$$$