BJM3H2
-OEChem-04042103053D
49 53 0 0 0 0 0 0 0999 V2000
2.7821 3.7364 1.3118 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.7607 -2.1876 -0.1856 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7355 -2.4380 -0.9152 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5913 -0.5589 -1.7075 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3648 1.4486 -0.2432 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5941 0.1643 -1.8700 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7907 2.4469 -2.1713 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3260 -3.3915 0.3806 N 0 0 0 0 0 0 0 0 0 0 0 0
1.9989 3.4004 -1.2311 N 0 0 0 0 0 0 0 0 0 0 0 0
1.8086 0.0142 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7048 -0.3193 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5606 -2.3017 -0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6901 -1.5681 -0.7251 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9928 0.4311 -1.5546 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6902 -1.8081 -1.0529 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0059 1.3228 -1.5485 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0046 -3.4328 0.1498 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3831 1.1037 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7013 0.4182 0.6715 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3663 2.8211 -0.0156 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2178 -4.5841 0.6202 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5947 0.7861 0.3419 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5343 2.0469 0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7803 -0.4250 0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9531 0.2478 1.8363 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9575 1.4119 1.5346 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8969 2.6727 1.4995 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1110 -1.4387 1.3056 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2838 -0.7656 2.7358 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1085 2.3552 2.1135 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3629 -1.6089 2.4703 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6740 -0.6365 -2.1184 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6589 0.1776 -3.3224 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7696 -0.2649 -1.8934 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8835 1.1893 -2.3395 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2481 -5.1011 -0.2249 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8366 -5.3107 1.1573 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5756 -4.2546 1.2991 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9114 4.3822 -1.4605 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2658 0.0525 -0.0967 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5899 2.3119 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3832 -0.2962 -0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1004 0.8870 2.0506 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9007 1.1646 2.0128 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2362 3.4080 1.9496 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9527 -2.0936 1.1002 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6987 -0.9009 3.6406 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3909 2.8426 3.0421 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6197 -2.3986 3.1702 H 0 0 0 0 0 0 0 0 0 0 0 0
1 20 2 0 0 0 0
2 8 1 0 0 0 0
2 13 1 0 0 0 0
3 15 2 0 0 0 0
4 6 1 0 0 0 0
4 10 1 0 0 0 0
4 15 1 0 0 0 0
5 16 1 0 0 0 0
5 19 1 0 0 0 0
5 20 1 0 0 0 0
6 11 2 0 0 0 0
7 9 1 0 0 0 0
7 16 2 0 0 0 0
8 17 2 0 0 0 0
9 20 1 0 0 0 0
9 39 1 0 0 0 0
10 16 1 0 0 0 0
10 32 1 0 0 0 0
10 33 1 0 0 0 0
11 13 1 0 0 0 0
11 14 1 0 0 0 0
12 13 2 0 0 0 0
12 15 1 0 0 0 0
12 17 1 0 0 0 0
14 18 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
17 21 1 0 0 0 0
18 22 2 0 0 0 0
18 23 1 0 0 0 0
19 24 2 0 0 0 0
19 25 1 0 0 0 0
21 36 1 0 0 0 0
21 37 1 0 0 0 0
21 38 1 0 0 0 0
22 26 1 0 0 0 0
22 40 1 0 0 0 0
23 27 2 0 0 0 0
23 41 1 0 0 0 0
24 28 1 0 0 0 0
24 42 1 0 0 0 0
25 29 2 0 0 0 0
25 43 1 0 0 0 0
26 30 2 0 0 0 0
26 44 1 0 0 0 0
27 30 1 0 0 0 0
27 45 1 0 0 0 0
28 31 2 0 0 0 0
28 46 1 0 0 0 0
29 31 1 0 0 0 0
29 47 1 0 0 0 0
30 48 1 0 0 0 0
31 49 1 0 0 0 0
M END
$$$$