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recap
-ISIS- 2D
Used JOELib chemistry kernel (expert systems) ID is 715333816
73 76 0 0 0 0 0 0 0 0 2 V2000
6.5740 -6.8907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5480 -5.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1953 -5.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5740 -8.3980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6267 -6.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0073 -5.1047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3740 -3.4073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
13.0213 -5.7000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
15.4407 -4.8640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
17.6193 -6.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
20.7480 -4.9907 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
19.8740 -3.7240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
22.2173 -4.4713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
21.7740 -6.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
18.5313 -7.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.7453 -8.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
20.3047 -8.6767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
20.2667 -10.9313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.9100 -10.8047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.2713 -9.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8527 -10.6907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1833 -10.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1833 -12.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7640 -11.9953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9167 -12.7427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6760 -13.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5360 -14.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4360 -14.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1953 -15.9980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1693 -16.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4093 -15.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3573 -10.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3953 -9.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4193 -9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3307 -7.8407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.5833 -10.4120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0907 -7.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2480 -13.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4260 -12.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.6927 -13.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.1240 -13.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
14.3387 -15.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
16.8720 -14.9213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
17.5433 -15.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
18.4553 -14.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
21.8120 -12.4260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
23.6740 -11.8433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
25.1433 -13.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
26.6887 -12.6287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
24.9407 -15.1240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
26.9673 -11.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
26.2073 -9.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
27.9173 -8.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
26.8787 -6.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
27.6767 -5.7380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
26.6887 -4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
28.2340 -3.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
25.4980 -3.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
25.9667 -1.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
27.8287 -0.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
28.7407 -1.4313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
24.3073 -3.6480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
15.4787 -2.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.8573 -1.7860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.4027 -1.0640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
16.6313 -1.7480 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
17.8980 -0.7980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
19.3167 -2.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
20.5833 -1.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.8213 -2.8120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
16.5933 -0.5573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.5407 -10.4120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.5027 -8.6767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 0 0 0 0
3 1 1 0 0 0 0
4 1 1 0 0 0 0
5 3 1 0 0 0 0
6 5 1 0 0 0 0
7 6 1 0 0 0 0
8 6 1 0 0 0 0
9 8 1 0 0 0 0
10 9 1 0 0 0 0
11 10 1 0 0 0 0
12 11 1 0 0 0 0
13 11 1 0 0 0 0
14 11 1 0 0 0 0
15 10 1 0 0 0 0
16 15 2 0 0 0 0
17 15 1 0 0 0 0
18 17 2 0 0 0 0
19 16 1 0 0 0 0
18 19 1 0 0 0 0
20 4 1 0 0 0 0
21 20 2 0 0 0 0
22 20 1 0 0 0 0
23 22 2 0 0 0 0
24 21 1 0 0 0 0
25 24 2 0 0 0 0
25 23 1 0 0 0 0
26 25 1 0 0 0 0
27 26 1 0 0 0 0
28 26 2 0 0 0 0
29 28 1 0 0 0 0
30 29 2 0 0 0 0
31 30 1 0 0 0 0
31 27 2 0 0 0 0
32 21 1 0 0 0 0
33 32 1 0 0 0 0
34 33 1 0 0 0 0
35 34 1 0 0 0 0
36 34 2 0 0 0 0
37 35 1 0 0 0 0
38 23 1 0 0 0 0
39 38 1 0 0 0 0
40 39 1 0 0 0 0
41 40 2 0 0 0 0
42 40 1 0 0 0 0
43 42 1 0 0 0 0
44 43 1 0 0 0 0
45 44 1 0 0 0 0
46 18 1 0 0 0 0
47 46 1 0 0 0 0
48 47 1 0 0 0 0
49 48 1 0 0 0 0
50 48 2 0 0 0 0
51 49 1 0 0 0 0
52 51 1 0 0 0 0
53 52 2 0 0 0 0
54 53 1 0 0 0 0
55 54 1 0 0 0 0
56 55 1 0 0 0 0
57 56 1 0 0 0 0
58 56 1 0 0 0 0
59 58 1 0 0 0 0
60 59 1 0 0 0 0
61 60 1 0 0 0 0
61 57 1 0 0 0 0
62 58 2 0 0 0 0
63 9 1 0 0 0 0
64 63 1 0 0 0 0
65 64 1 0 0 0 0
66 65 1 0 0 0 0
67 66 1 0 0 0 0
68 67 1 0 0 0 0
69 68 1 0 0 0 0
70 66 2 0 0 0 0
71 66 2 0 0 0 0
72 19 1 0 0 0 0
73 72 1 0 0 0 0
M CHG 1 11 1
M END
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