BQT5A3 -OEChem-04022105332D 57 60 0 1 0 0 0 0 0999 V2000 3.4022 -1.3405 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9163 2.4638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8989 -2.2045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9056 -0.4764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 -1.8438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 -0.8371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9273 0.2085 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0173 -0.2983 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7934 -0.2915 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.6594 0.2085 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0093 -1.3399 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6594 1.2085 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9273 1.2085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8094 -1.3330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9114 -1.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7934 1.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0905 0.2658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6056 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0739 -1.8896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 0.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1426 -0.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1343 -1.3471 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.6056 1.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1892 0.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6594 2.2085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6635 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5328 -0.7108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7493 -0.6367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0126 -2.1899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7153 1.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3168 1.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0275 -1.9134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4186 -1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5141 -2.3367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3124 -2.3336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1919 2.1835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3948 2.1835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 0.7324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7006 0.7478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3546 -0.6631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 -0.4054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6766 -2.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4748 -2.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6450 0.6969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0298 1.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4051 0.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9381 0.3231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -0.3636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5991 -1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6501 0.2938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6501 1.1233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2794 2.2085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6594 2.8285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0394 2.2085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2639 -2.4638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5405 -0.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 23 2 0 0 0 0 22 5 1 6 0 0 0 5 55 1 0 0 0 0 6 56 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 26 1 6 0 0 0 8 11 1 0 0 0 0 8 17 1 0 0 0 0 8 20 1 1 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 27 1 1 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 10 28 1 6 0 0 0 11 15 1 0 0 0 0 11 19 1 0 0 0 0 11 29 1 6 0 0 0 12 16 1 0 0 0 0 12 23 1 0 0 0 0 12 25 1 1 0 0 0 13 16 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 21 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 24 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 22 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 M END $$$$