B6PI3A -OEChem-04012113443D 50 51 0 1 0 0 0 0 0999 V2000 0.5520 4.8045 -0.4833 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0599 -0.3829 2.6748 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3033 -2.2753 -1.3463 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8026 1.7901 2.5905 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4565 -0.2650 -0.1298 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3869 -1.3513 -1.2605 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8909 -0.2057 -0.2612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2999 -0.1126 -1.7321 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5552 -1.4160 0.3981 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 -0.1572 -1.8873 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 -1.4121 0.1656 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1639 0.8096 0.6041 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1291 2.1707 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2181 -1.3537 -0.7194 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2909 0.8101 2.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9395 3.2106 0.2978 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6835 -1.3992 -0.5936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2704 -2.0446 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.7973 -1.5628 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6594 -2.0881 0.6143 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 -0.8408 -1.4435 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4575 -0.4621 4.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2071 4.4543 -2.1307 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4617 -1.4863 -0.3549 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2801 0.6839 0.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9244 0.8219 -2.1661 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8782 -0.9152 -2.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1617 -2.3693 0.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3607 -1.4066 1.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2731 0.7421 -1.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0789 -0.1562 -2.9516 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5036 -2.3215 0.5909 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5294 -0.5671 0.6884 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2488 0.6787 0.6363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0053 -2.1784 -1.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1423 2.0398 -1.1299 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1202 2.5492 0.2397 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 3.3790 1.3786 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9361 2.8778 -0.0108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6543 -2.5172 1.2557 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0387 -0.2904 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1161 -2.5903 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.3715 -2.1978 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2151 -1.4632 4.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5368 -0.3068 4.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0914 0.2729 4.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2659 4.1878 -2.0755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6477 3.6486 -2.6118 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1115 5.3511 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5433 -1.5199 -0.2619 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 23 1 0 0 0 0 2 15 1 0 0 0 0 2 22 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 34 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 41 1 0 0 0 0 20 24 2 0 0 0 0 20 42 1 0 0 0 0 21 24 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 M END $$$$