D0M2RC -OEChem-04152122343D 30 30 0 1 0 0 0 0 0999 V2000 -0.9567 -1.6616 -0.3142 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3425 -1.5470 -1.7078 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8889 -2.9645 0.3193 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3482 0.8354 0.3152 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6431 2.3678 -0.4324 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 0.2677 -0.0168 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.6412 0.6281 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0447 0.7953 0.2926 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6336 -0.9133 -0.1255 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5905 1.6221 1.4834 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 0.0643 -1.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4522 -1.3187 0.9144 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 1.0704 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 0.6548 -0.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7071 -0.7281 1.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 0.2586 0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7105 1.8381 -0.6329 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4555 1.0376 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2571 -0.9380 1.5578 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.3685 1.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6216 2.6931 1.2572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2332 1.4515 2.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3987 0.3815 -1.8446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1433 -2.0788 1.6251 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5473 1.4133 -1.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3549 -1.0392 1.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5756 2.5715 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0439 2.7054 -0.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7737 1.4289 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7132 2.1878 -0.3664 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 13 1 0 0 0 0 5 27 1 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 18 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 14 1 0 0 0 0 11 23 1 0 0 0 0 12 15 2 0 0 0 0 12 24 1 0 0 0 0 14 16 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 M END $$$$