BH5J7M -OEChem-04022102163D 37 40 0 0 0 0 0 0 0999 V2000 4.7236 -2.2864 0.0997 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 1.7628 -0.0581 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1158 -0.9203 0.0146 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2608 -1.4833 0.0664 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4016 1.4159 -0.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9344 0.7696 -0.0118 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7858 0.0193 -0.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4862 -0.5663 0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 3.1283 -0.1105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1279 2.5871 -0.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2113 -0.3712 0.0083 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2951 1.0822 -0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 3.6634 -0.1869 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4417 -1.5866 0.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8046 -1.2822 0.0628 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2285 0.0468 0.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0403 0.0685 1.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7274 -1.1801 -1.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3852 -0.3008 1.0602 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0723 -1.5494 -0.9845 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9011 -1.1098 0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0988 -1.9070 0.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0192 3.6233 -0.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2047 2.6669 -0.2265 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6551 2.1056 -0.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4432 4.7167 -0.2512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1241 -2.6269 0.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 0.3471 0.0393 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6518 0.6912 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -1.5271 -1.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0206 0.0466 1.8709 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4626 -2.1795 -1.7796 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8626 -1.1661 0.8147 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6347 -2.0708 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -2.8294 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3541 -1.3353 1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3767 -1.3817 -0.8129 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 22 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 3 7 2 0 0 0 0 3 8 1 0 0 0 0 4 21 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 11 1 0 0 0 0 8 14 1 0 0 0 0 9 13 2 0 0 0 0 9 23 1 0 0 0 0 10 13 1 0 0 0 0 10 24 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 16 2 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 30 1 0 0 0 0 19 21 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 M END $$$$