B7JG5X -OEChem-04022112043D 55 58 0 1 0 0 0 0 0999 V2000 -3.4145 -1.6093 -0.6196 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7723 -1.0240 -1.7825 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6218 -2.3993 -0.7851 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 2.5860 0.5137 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9701 0.1991 0.3752 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6015 -3.2591 -0.0955 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0802 0.9986 2.3573 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3264 -4.2612 1.0696 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3043 0.2254 0.7138 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4224 0.4130 -0.7479 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6201 -0.3667 0.6140 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1963 -2.6328 0.1897 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 1.0130 0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1524 -0.4552 0.9484 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -1.7937 0.7692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7047 1.4996 0.5135 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1492 -2.6276 1.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1582 1.5908 -0.2691 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0228 0.3404 1.3342 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1845 0.9200 0.6088 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4138 0.9462 -0.5361 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3639 0.1438 0.0608 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1099 2.3365 0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7098 -4.0571 0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6173 0.2644 0.6607 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8371 3.3545 0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1968 -0.6917 -1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3144 2.6215 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0729 -4.6574 -1.2917 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7038 -0.4503 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 4.6577 0.1966 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2832 -1.4064 -1.5481 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 3.9245 -1.5299 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5368 -1.2858 -0.9482 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9733 4.9427 -0.9131 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0146 -0.7423 1.5641 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6995 -3.1935 0.9835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8435 -3.3322 -0.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1372 -3.3930 1.8168 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9613 -2.0453 1.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1191 2.6568 -0.4731 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3405 0.9730 1.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 0.9077 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4578 3.1494 1.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2334 -0.7962 -1.5349 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7455 1.8439 -1.5392 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1204 -3.8771 -2.0555 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0589 -5.1251 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3355 -5.4154 -1.5657 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6796 -0.3570 0.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3342 5.4505 0.6773 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -2.0553 -2.4093 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6278 4.1463 -2.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3826 -1.8422 -1.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9201 5.9572 -1.2971 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 4 16 2 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 17 1 0 0 0 0 6 24 1 0 0 0 0 7 19 2 0 0 0 0 8 24 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 10 21 3 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 12 15 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 21 1 0 0 0 0 18 41 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 20 42 1 0 0 0 0 22 25 2 0 0 0 0 22 27 1 0 0 0 0 23 26 2 0 0 0 0 23 28 1 0 0 0 0 24 29 1 0 0 0 0 25 30 1 0 0 0 0 25 43 1 0 0 0 0 26 31 1 0 0 0 0 26 44 1 0 0 0 0 27 32 2 0 0 0 0 27 45 1 0 0 0 0 28 33 2 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 34 2 0 0 0 0 30 50 1 0 0 0 0 31 35 2 0 0 0 0 31 51 1 0 0 0 0 32 34 1 0 0 0 0 32 52 1 0 0 0 0 33 35 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 35 55 1 0 0 0 0 M END $$$$