B1RU3Y
-OEChem-04022109513D
55 58 0 1 0 0 0 0 0999 V2000
3.7321 1.0599 0.4736 S 0 0 0 0 0 0 0 0 0 0 0 0
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4.2786 2.2255 -0.1945 O 0 0 0 0 0 0 0 0 0 0 0 0
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-2.1389 1.8598 0.6104 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4353 -1.6229 -0.0169 C 0 0 1 0 0 0 0 0 0 0 0 0
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3.2533 -0.1477 -1.9329 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3493 -1.3594 -2.1076 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5924 -2.2666 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9789 1.2656 0.5569 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3356 2.0874 -0.3698 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2483 0.5969 1.5591 C 0 0 0 0 0 0 0 0 0 0 0 0
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2.5698 -1.5382 0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3529 -3.2452 -1.0115 H 0 0 0 0 0 0 0 0 0 0 0 0
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2.7299 0.7849 -2.1284 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2498 -1.6583 -3.1547 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3479 -1.1432 -1.7163 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3053 -3.2737 1.0505 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8694 -1.6904 1.6125 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8701 2.6279 -1.1417 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7512 -0.0364 2.2858 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6798 0.2208 2.4401 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9964 2.0705 1.5004 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8002 1.2779 2.5042 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6498 -2.9938 -0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5901 -3.9691 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1466 -2.3489 1.3455 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6747 -1.1415 2.4846 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8806 0.9072 -0.6061 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5458 -3.2873 1.6865 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7625 -1.2199 -1.3991 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3382 -4.4644 0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9239 -4.9868 -1.8977 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4527 -3.2908 -2.4789 H 0 0 0 0 0 0 0 0 0 0 0 0
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31 55 1 0 0 0 0
M END
$$$$