BCD5M4
-OEChem-04042101503D
47 49 0 0 0 0 0 0 0999 V2000
5.1650 -3.1669 -0.0232 F 0 0 0 0 0 0 0 0 0 0 0 0
3.0388 -3.6003 0.1184 F 0 0 0 0 0 0 0 0 0 0 0 0
3.6679 -1.6084 -0.6990 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6187 -1.4664 -0.3063 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1133 -0.0796 1.0682 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8281 0.7024 -1.0996 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.7955 1.2199 1.1973 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6976 2.2963 0.2881 N 0 0 0 0 0 0 0 0 0 0 0 0
6.4962 1.4605 1.6083 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2609 0.7440 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0850 0.5092 -1.7865 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4616 -0.5760 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6492 2.0239 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1022 0.0356 0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9958 -0.3251 -0.3827 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1329 -0.8320 0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5843 -0.2834 0.6127 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1471 -0.3049 -0.3845 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5659 1.2841 0.6797 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0811 -0.0851 0.4528 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8976 3.2113 -1.0277 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3879 1.2319 0.7552 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1335 0.9978 0.5601 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0852 -1.2912 -0.2111 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1836 1.2711 -0.3164 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1352 -1.0180 -1.0877 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6845 0.2632 -1.1404 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9609 -2.6139 0.2635 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1076 1.1857 -2.6472 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0974 -0.5022 -2.2075 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3332 -1.6513 1.7217 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6140 -0.1022 2.5274 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4024 1.6222 -1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2515 -1.8939 0.3229 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0637 2.2411 0.6623 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7018 -0.8835 0.8458 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8773 3.2292 -0.6353 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3822 4.1380 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8790 3.2350 -2.1212 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7559 1.7915 1.1992 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6655 -2.2932 -0.1817 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6118 2.2684 -0.3568 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5250 -1.8026 -1.7296 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5021 0.4759 -1.8228 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7396 0.7466 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7126 2.4243 1.8308 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9246 -2.2751 1.3049 H 0 0 0 0 0 0 0 0 0 0 0 0
1 28 1 0 0 0 0
2 28 1 0 0 0 0
3 15 1 0 0 0 0
3 28 1 0 0 0 0
4 18 2 0 0 0 0
5 7 1 0 0 0 0
5 12 1 0 0 0 0
5 16 1 0 0 0 0
6 11 1 0 0 0 0
6 18 1 0 0 0 0
6 33 1 0 0 0 0
7 19 2 0 0 0 0
8 13 1 0 0 0 0
8 22 2 0 0 0 0
9 22 1 0 0 0 0
9 45 1 0 0 0 0
9 46 1 0 0 0 0
10 11 1 0 0 0 0
10 13 2 0 0 0 0
10 15 1 0 0 0 0
11 29 1 0 0 0 0
11 30 1 0 0 0 0
12 17 1 0 0 0 0
12 31 1 0 0 0 0
12 32 1 0 0 0 0
13 21 1 0 0 0 0
14 16 2 0 0 0 0
14 18 1 0 0 0 0
14 19 1 0 0 0 0
15 20 2 0 0 0 0
16 34 1 0 0 0 0
17 23 2 0 0 0 0
17 24 1 0 0 0 0
19 35 1 0 0 0 0
20 22 1 0 0 0 0
20 36 1 0 0 0 0
21 37 1 0 0 0 0
21 38 1 0 0 0 0
21 39 1 0 0 0 0
23 25 1 0 0 0 0
23 40 1 0 0 0 0
24 26 2 0 0 0 0
24 41 1 0 0 0 0
25 27 2 0 0 0 0
25 42 1 0 0 0 0
26 27 1 0 0 0 0
26 43 1 0 0 0 0
27 44 1 0 0 0 0
28 47 1 0 0 0 0
M END
$$$$