D0M1JT -OEChem-10101305022D 37 40 0 0 0 0 0 0 0999 V2000 4.3830 0.3246 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9814 -0.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -1.8661 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 -1.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -1.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0065 -0.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7595 -0.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 0.3246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 -2.8508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4691 -2.1525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9972 -3.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8169 1.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2295 -2.1524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -0.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2318 -1.8530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8141 1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2536 2.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6874 2.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6846 3.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6616 -0.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5716 -3.2800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0836 -2.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2663 -3.5861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3744 -2.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 0.4711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7789 -2.2765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4082 -0.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1634 0.7880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6353 2.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8662 2.2476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3382 3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9537 3.5861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2071 -1.3895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0833 -1.4223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1161 -0.5461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 6 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 4 6 1 0 0 0 0 4 10 2 0 0 0 0 5 7 1 0 0 0 0 5 13 2 0 0 0 0 6 8 2 0 0 0 0 7 14 2 0 0 0 0 8 12 1 0 0 0 0 9 11 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 M END $$$$