L98EGR -OEChem-05022321342D 53 55 0 0 0 0 0 0 0999 V2000 8.9472 4.3442 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -4.0193 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -2.6532 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -2.2872 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4608 -1.5144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9973 0.0901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1382 4.9320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7562 3.7564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -1.5655 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5961 1.1082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -2.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 -1.5655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -3.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -1.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6751 -1.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 -3.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0028 0.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 -1.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 -3.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 -4.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -3.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 -4.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1839 1.9172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -5.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3594 3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7771 2.8307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1784 1.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3649 3.6397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7662 2.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 5.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0506 -0.1128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6664 -2.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -2.4219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4835 -2.4641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2648 -2.0661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8667 -1.2848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 -0.8236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1207 -0.6579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -3.3432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5121 -4.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9795 1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -4.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -5.7732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1605 2.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4306 1.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1127 4.2061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3828 2.5569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0366 4.7888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8994 5.6548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0334 5.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 27 1 0 0 0 0 1 32 1 0 0 0 0 2 23 1 0 0 0 0 3 23 1 0 0 0 0 4 23 1 0 0 0 0 5 20 1 0 0 0 0 5 50 1 0 0 0 0 6 19 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 10 19 1 0 0 0 0 10 25 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 33 1 0 0 0 0 15 18 1 0 0 0 0 15 21 2 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 24 1 0 0 0 0 21 41 1 0 0 0 0 22 26 1 0 0 0 0 22 42 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 28 2 0 0 0 0 25 29 1 0 0 0 0 26 45 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 28 30 1 0 0 0 0 28 46 1 0 0 0 0 29 31 2 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$