B5KGW2 -OEChem-04022103323D 31 32 0 0 0 0 0 0 0999 V2000 -5.7525 -1.0450 0.3264 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.5382 1.0240 0.9410 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.5587 0.5173 -1.1736 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3186 1.6752 -0.4631 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5656 -0.4827 0.0677 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3015 1.3739 0.5845 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8432 -0.3351 0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5965 -0.0473 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9243 0.0256 -0.1285 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6393 -1.4330 0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3919 0.9034 -0.2255 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0267 -1.2879 0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7791 1.0484 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5461 0.4871 -0.1834 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9463 0.9169 0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2238 -1.3089 -0.4023 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2677 0.4734 0.2519 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0798 0.1081 0.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5451 -1.7523 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5671 -0.8612 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2057 -2.4037 0.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 1.7968 -0.4499 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8705 -1.4165 0.3286 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6467 -2.1529 0.5492 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2154 2.0186 -0.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 1.9581 0.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4687 -2.0306 -0.6993 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7799 -2.7893 -0.5709 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5931 -1.2187 0.0149 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0859 2.3425 0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2599 1.0532 0.6203 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 18 1 0 0 0 0 3 18 1 0 0 0 0 4 14 2 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 5 23 1 0 0 0 0 6 17 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 8 18 1 0 0 0 0 9 14 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 11 13 2 0 0 0 0 11 22 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 16 19 2 0 0 0 0 16 27 1 0 0 0 0 17 20 2 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 M END $$$$