B7R0PY
-OEChem-04022108313D
29 31 0 0 0 0 0 0 0999 V2000
-3.1833 -0.5119 0.8400 S 0 0 0 0 0 0 0 0 0 0 0 0
3.5429 -0.4301 -0.3309 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1180 -2.6418 -0.2477 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9600 1.7828 -0.4122 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7159 0.8839 -0.2211 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8397 0.1015 0.1363 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5303 0.3710 0.3727 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2834 -1.2133 0.0666 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7330 1.1532 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4206 -0.7012 0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9640 1.7035 0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3861 -2.2751 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9629 -2.0162 0.4626 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2893 2.4788 0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0576 2.7501 0.2757 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7067 -1.4891 -0.1813 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1552 0.8695 -0.2696 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8335 -0.4857 -0.8509 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3461 -0.3300 -0.8617 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0012 1.9721 0.6178 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7188 -3.3083 0.1767 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6387 -2.8598 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9763 3.3116 -0.0802 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4018 3.7791 0.3291 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3748 0.3585 -1.3765 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5519 -1.4093 -1.3663 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8465 -1.1634 -0.3569 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7130 -0.2922 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3724 0.8494 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 18 1 0 0 0 0
2 16 1 0 0 0 0
2 17 1 0 0 0 0
3 16 2 0 0 0 0
4 17 2 0 0 0 0
5 19 1 0 0 0 0
5 29 1 0 0 0 0
6 7 1 0 0 0 0
6 8 2 0 0 0 0
6 9 1 0 0 0 0
7 10 2 0 0 0 0
7 11 1 0 0 0 0
8 12 1 0 0 0 0
8 16 1 0 0 0 0
9 14 2 0 0 0 0
9 17 1 0 0 0 0
10 13 1 0 0 0 0
11 15 2 0 0 0 0
11 20 1 0 0 0 0
12 13 2 0 0 0 0
12 21 1 0 0 0 0
13 22 1 0 0 0 0
14 15 1 0 0 0 0
14 23 1 0 0 0 0
15 24 1 0 0 0 0
18 19 1 0 0 0 0
18 25 1 0 0 0 0
18 26 1 0 0 0 0
19 27 1 0 0 0 0
19 28 1 0 0 0 0
M END
$$$$