L4JQI3 -OEChem-05022323452D 58 60 0 1 0 0 0 0 0999 V2000 5.5714 3.7785 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0312 0.2958 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -4.2920 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3804 4.3662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7623 3.1907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8402 -4.2920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8402 -4.2920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1591 2.9694 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.1537 3.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5604 3.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7524 2.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 4.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5549 4.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9726 4.7965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3402 1.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 4.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3402 1.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -0.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6492 0.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 5.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7062 -1.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 -1.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 5.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.4649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -3.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7062 -2.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 -2.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -5.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1104 2.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 2.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9248 3.4859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2384 2.4026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3217 1.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5408 4.8593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8127 5.1835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6197 3.4754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1715 4.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4901 4.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4742 5.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6082 5.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 4.4321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7046 1.7485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2389 0.1042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 5.8584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 3.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2432 -1.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4372 -1.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 5.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 2.8985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2432 -3.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4372 -3.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 4.2091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2202 -5.2920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8402 -5.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4602 -5.2920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 15 1 0 0 0 0 2 18 1 0 0 0 0 3 6 2 0 0 0 0 3 7 2 0 0 0 0 3 27 1 0 0 0 0 3 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 34 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 16 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 17 2 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 46 1 0 0 0 0 20 25 1 0 0 0 0 20 47 1 0 0 0 0 21 26 2 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 28 1 0 0 0 0 23 49 1 0 0 0 0 24 29 2 0 0 0 0 24 50 1 0 0 0 0 25 30 2 0 0 0 0 25 51 1 0 0 0 0 26 30 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$