BMK4I7
-OEChem-04042101443D
54 58 0 0 0 0 0 0 0999 V2000
3.3888 -2.3140 -1.2934 S 0 0 0 0 0 0 0 0 0 0 0 0
0.5457 1.1031 2.2138 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4428 0.0634 -1.7497 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4744 -1.7121 -2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2567 -3.4013 -1.7035 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0542 6.3244 -0.8518 O 0 5 0 0 0 0 0 0 0 0 0 0
0.4385 5.7023 0.6327 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9649 -0.5087 1.4396 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5285 -2.7895 0.0933 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5328 5.4486 -0.1200 N 0 3 0 0 0 0 0 0 0 0 0 0
-2.0385 -0.7889 0.6061 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5940 0.1540 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4056 -1.5685 2.2668 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7473 -2.0612 0.4085 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1012 1.5221 -0.1979 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7565 -1.8530 -0.5315 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0159 1.8380 0.6334 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4050 0.7881 1.4993 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5060 -2.5076 1.4797 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7049 -0.4584 -0.9409 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6884 -1.8085 0.8141 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6136 -3.3360 0.9402 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6549 2.5285 -0.9988 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4962 3.1394 0.6589 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6325 -2.8321 -0.9696 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0582 4.1296 -0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1352 3.8247 -0.9713 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4834 -4.3542 0.5197 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4854 -4.1042 -0.4283 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4295 -1.0359 -0.6545 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6929 -1.3504 -0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9859 0.2864 -0.6473 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5128 -0.3426 0.3537 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8057 1.2943 -0.1397 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 0.9798 0.3609 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2014 -2.0790 2.8148 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2023 -1.1083 3.0564 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8815 -3.2805 2.1623 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0344 -3.0373 0.6909 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3034 -1.3119 1.5719 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3233 -1.0562 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8882 -3.6125 1.6904 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4952 2.3320 -1.6573 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3456 3.3656 1.3088 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4030 -2.6242 -1.7028 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5992 4.5711 -1.6115 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9072 -3.5553 0.6644 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3824 -5.3520 0.9395 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1480 -4.9071 -0.7379 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0556 -2.3742 -0.1424 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0043 0.5537 -1.0282 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4958 -0.5875 0.7453 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4596 2.3238 -0.1326 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7069 1.7645 0.7571 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 9 1 0 0 0 0
1 30 1 0 0 0 0
2 18 2 0 0 0 0
3 20 2 0 0 0 0
6 10 1 0 0 0 0
7 10 2 0 0 0 0
8 11 1 0 0 0 0
8 13 1 0 0 0 0
8 18 1 0 0 0 0
9 21 1 0 0 0 0
9 47 1 0 0 0 0
10 26 1 0 0 0 0
11 12 2 0 0 0 0
11 14 1 0 0 0 0
12 15 1 0 0 0 0
12 20 1 0 0 0 0
13 19 1 0 0 0 0
13 36 1 0 0 0 0
13 37 1 0 0 0 0
14 16 1 0 0 0 0
14 22 2 0 0 0 0
15 17 2 0 0 0 0
15 23 1 0 0 0 0
16 20 1 0 0 0 0
16 25 2 0 0 0 0
17 18 1 0 0 0 0
17 24 1 0 0 0 0
19 21 1 0 0 0 0
19 38 1 0 0 0 0
19 39 1 0 0 0 0
21 40 1 0 0 0 0
21 41 1 0 0 0 0
22 28 1 0 0 0 0
22 42 1 0 0 0 0
23 27 2 0 0 0 0
23 43 1 0 0 0 0
24 26 2 0 0 0 0
24 44 1 0 0 0 0
25 29 1 0 0 0 0
25 45 1 0 0 0 0
26 27 1 0 0 0 0
27 46 1 0 0 0 0
28 29 2 0 0 0 0
28 48 1 0 0 0 0
29 49 1 0 0 0 0
30 31 2 0 0 0 0
30 32 1 0 0 0 0
31 33 1 0 0 0 0
31 50 1 0 0 0 0
32 34 2 0 0 0 0
32 51 1 0 0 0 0
33 35 2 0 0 0 0
33 52 1 0 0 0 0
34 35 1 0 0 0 0
34 53 1 0 0 0 0
35 54 1 0 0 0 0
M CHG 2 6 -1 10 1
M END
$$$$