BPH21T -OEChem-04022119003D 50 51 0 1 0 0 0 0 0999 V2000 3.9503 1.7736 0.2312 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4763 2.0589 -1.0902 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1334 2.7251 1.3103 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7623 -1.9935 -1.6634 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6553 -1.2967 0.3024 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0401 0.1838 -0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8941 -1.4021 1.0382 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 0.2511 0.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9272 -0.9288 0.0261 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4635 -1.9955 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2844 -0.9395 -0.1110 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8860 -3.0427 -0.3071 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -2.7078 1.7129 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2112 1.4964 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6893 -1.4031 -0.4422 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6797 1.0561 -1.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3705 1.7181 1.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5332 1.0591 -0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3076 0.8375 -1.2565 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 1.4996 1.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9564 0.8315 -0.2913 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -0.1380 -1.1737 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8525 1.5831 0.4691 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8052 -0.3559 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2247 1.3654 0.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 0.3959 -0.5357 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5691 -0.7831 0.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7479 -1.8485 0.7791 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6229 -1.5016 1.1568 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7994 -0.6527 -1.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 0.0990 1.7243 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -3.7592 0.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2605 -2.5652 -1.0687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6744 -3.6052 -0.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 -2.0007 2.4049 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6786 -3.3704 2.3131 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0951 -3.3336 1.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 0.8900 -2.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7653 2.0471 2.1248 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0646 0.5253 -2.2284 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6125 1.6542 1.9315 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 -2.3064 -1.8643 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7726 -0.7681 -1.7633 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5299 2.3696 1.1459 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -1.1168 -1.9807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9181 1.9592 0.9363 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3741 -0.3585 -0.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2095 -2.5469 0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5288 -1.2742 1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1577 -2.3987 1.5156 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 8 1 0 0 0 0 1 14 1 0 0 0 0 4 15 1 0 0 0 0 4 42 1 0 0 0 0 5 15 2 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 27 2 0 0 0 0 8 11 1 0 0 0 0 8 31 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 29 1 0 0 0 0 11 15 1 0 0 0 0 11 30 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 16 19 1 0 0 0 0 16 38 1 0 0 0 0 17 20 2 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END $$$$