L2TQM3 -OEChem-05022323193D 42 45 0 0 0 0 0 0 0999 V2000 5.5612 1.9062 0.8001 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7208 -0.8794 0.5838 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2858 -0.6665 -0.4422 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7579 1.0614 -0.0703 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5195 1.3177 -0.0582 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9498 -0.6852 -0.2234 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2205 -2.7292 -0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3076 0.7728 -0.6134 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6004 1.1932 -1.3143 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1694 1.4693 0.7419 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8011 1.1344 -0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 1.4061 1.5551 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3003 2.4064 -0.1152 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5651 -0.0368 0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7208 2.3763 -0.6651 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3983 -0.6748 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 0.6952 -0.1534 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0932 -1.3964 -0.2457 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7294 -1.1360 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0046 0.0583 0.2388 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -1.4137 -0.0342 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -2.7842 0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0618 -3.3950 0.0842 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4751 1.0717 -1.2632 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 2.2305 -1.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7875 0.5783 -2.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3397 1.0661 1.3321 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9424 2.5264 0.5508 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0489 0.1048 -0.0935 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6797 1.5555 -0.8747 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3617 2.0258 2.4523 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6758 0.3832 1.8846 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1502 -1.1946 -0.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6491 3.0306 -0.7347 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2848 2.7794 0.9151 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2292 3.3298 -0.4936 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7096 2.1808 -1.7436 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6738 1.4376 -0.3001 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0624 -2.1547 0.3181 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5238 1.4516 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0687 -3.3753 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1583 -4.4691 0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 20 2 0 0 0 0 3 8 1 0 0 0 0 3 18 1 0 0 0 0 3 33 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 4 17 1 0 0 0 0 5 15 1 0 0 0 0 5 20 1 0 0 0 0 5 40 1 0 0 0 0 6 18 1 0 0 0 0 6 21 2 0 0 0 0 7 18 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 16 21 1 0 0 0 0 17 38 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$