B3PMH5 -OEChem-04022101382D 48 51 0 0 0 0 0 0 0999 V2000 4.6783 2.2104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8564 -2.2104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 0.1031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -0.1031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 -1.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 -1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8027 -2.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8027 -3.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 3.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2728 -3.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 3.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8564 -3.8198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6687 -2.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6687 -4.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5347 -2.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5347 -3.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6643 0.0158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2575 -0.5165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8704 -0.0158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2772 0.5165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 1.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 1.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9534 -1.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 -1.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 1.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 0.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1596 -1.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5663 -0.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 3.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6528 -3.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 4.4092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6638 -4.4092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6687 -1.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6687 -4.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.2051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0716 -2.2051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0716 -3.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 8 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 11 1 0 0 0 0 9 17 2 0 0 0 0 10 12 1 0 0 0 0 10 18 2 0 0 0 0 11 15 1 0 0 0 0 11 19 2 0 0 0 0 12 16 1 0 0 0 0 12 20 2 0 0 0 0 13 15 2 0 0 0 0 13 37 1 0 0 0 0 14 16 2 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 21 1 0 0 0 0 17 41 1 0 0 0 0 18 22 1 0 0 0 0 18 42 1 0 0 0 0 19 23 1 0 0 0 0 19 43 1 0 0 0 0 20 24 1 0 0 0 0 20 44 1 0 0 0 0 21 23 2 0 0 0 0 21 45 1 0 0 0 0 22 24 2 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 M END $$$$