BN37EZ -OEChem-04012116012D 55 59 0 1 0 0 0 0 0999 V2000 3.4384 -0.9395 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -3.5201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3239 3.1734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1328 -2.6587 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4032 -2.9688 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7204 -1.8568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4144 -0.7218 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1931 -1.3492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1881 -2.3492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.8383 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6418 0.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1408 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4294 -2.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4387 -3.6107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9121 0.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5988 0.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7672 -4.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4162 -3.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1395 1.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8262 1.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0965 2.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0731 -5.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7897 -4.1406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7221 -4.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0506 -5.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5942 3.8572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8216 4.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6372 3.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 5.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9076 4.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 5.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9782 -0.2813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6728 -1.3117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5381 -3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3364 -0.4609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0031 -1.2133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9969 -2.4533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3188 0.7560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0512 0.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8325 -3.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6871 2.3336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4195 1.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6567 -5.7631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9206 -3.5346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1837 -4.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6588 -4.7466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3281 -4.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2402 -6.1051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 5.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4962 2.9635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 6.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3142 4.0712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6826 5.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 13 2 0 0 0 0 3 22 1 0 0 0 0 3 27 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 14 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 35 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 6 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 10 13 1 0 0 0 0 10 15 1 6 0 0 0 10 34 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 36 1 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 20 1 0 0 0 0 16 40 1 0 0 0 0 17 21 2 0 0 0 0 17 41 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 25 1 0 0 0 0 19 42 1 0 0 0 0 20 22 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 23 26 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 51 1 0 0 0 0 29 31 2 0 0 0 0 29 52 1 0 0 0 0 30 32 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 M END $$$$