BMD74V
-OEChem-04022108263D
29 30 0 0 0 0 0 0 0999 V2000
-2.0506 3.5112 -0.0012 S 0 0 0 0 0 0 0 0 0 0 0 0
-3.5404 -1.2318 0.0036 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4748 1.3581 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.7728 0.9384 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7226 -3.4489 -0.0018 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2754 -0.3069 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9518 0.2433 1.2636 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9528 0.2429 -1.2637 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4555 -0.0247 1.2617 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4566 -0.0245 -1.2602 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1218 0.5168 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1904 0.0083 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1805 -0.9054 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6027 -0.4372 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7511 1.8676 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9280 -2.3071 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4380 -1.3920 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5082 -0.2162 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8007 1.3254 1.3619 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8015 1.3250 -1.3624 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5102 -0.2170 -2.1563 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6336 -1.1047 1.3342 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9126 0.4333 2.1462 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9145 0.4337 -2.1441 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6351 -1.1045 -1.3326 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0672 1.6124 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1845 0.2497 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2940 2.0208 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7258 1.2905 0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 2 0 0 0 0
2 14 2 0 0 0 0
3 12 1 0 0 0 0
3 15 1 0 0 0 0
3 28 1 0 0 0 0
4 14 1 0 0 0 0
4 15 1 0 0 0 0
4 29 1 0 0 0 0
5 16 3 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 12 1 0 0 0 0
6 17 1 0 0 0 0
7 9 1 0 0 0 0
7 18 1 0 0 0 0
7 19 1 0 0 0 0
8 10 1 0 0 0 0
8 20 1 0 0 0 0
8 21 1 0 0 0 0
9 11 1 0 0 0 0
9 22 1 0 0 0 0
9 23 1 0 0 0 0
10 11 1 0 0 0 0
10 24 1 0 0 0 0
10 25 1 0 0 0 0
11 26 1 0 0 0 0
11 27 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
13 16 1 0 0 0 0
M END
$$$$