B70TXM
-OEChem-04022107472D
72 74 0 1 0 0 0 0 0999 V2000
11.1554 5.6026 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
5.7408 10.1280 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.4304 4.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2069 8.7677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6200 8.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7659 10.3505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7157 9.9055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0288 7.4980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0288 5.2510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6200 6.3745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0568 2.9219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5431 3.7889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.6200 8.1066 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0539 7.2755 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.6200 6.3745 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.0539 5.4735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8106 6.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8106 5.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4304 8.0573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2513 4.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2513 8.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7046 7.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5183 3.5959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7046 5.3398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5183 9.1531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1200 7.2405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6378 2.6090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1200 7.2405 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
8.6106 6.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6106 5.8537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7297 2.1903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6200 6.3745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4545 2.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9633 11.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6384 1.1944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0635 2.8059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3632 1.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4551 0.6174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 8.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2587 7.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2901 5.8495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9151 8.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0438 8.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9457 7.6707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 5.8376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5877 3.7553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8226 4.5169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6974 8.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6974 4.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9470 9.3939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1819 8.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5000 7.2405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1464 7.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1464 5.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0831 6.6845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3100 5.8376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1569 6.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0176 2.2917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9300 8.6435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5678 10.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1013 11.7074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3589 11.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0754 0.9348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9916 3.4218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4477 2.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1354 2.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8696 0.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3985 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 8.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 8.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 7.4866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1554 5.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 72 1 0 0 0 0
2 6 2 0 0 0 0
2 7 2 0 0 0 0
2 25 1 0 0 0 0
2 34 1 0 0 0 0
3 16 2 0 0 0 0
4 21 2 0 0 0 0
5 26 2 0 0 0 0
8 14 1 0 0 0 0
8 17 1 0 0 0 0
8 21 1 0 0 0 0
9 16 1 0 0 0 0
9 18 1 0 0 0 0
9 20 1 0 0 0 0
15 10 1 1 0 0 0
10 26 1 0 0 0 0
10 45 1 0 0 0 0
11 12 1 0 0 0 0
11 31 1 0 0 0 0
11 36 1 0 0 0 0
12 23 2 0 0 0 0
28 13 1 6 0 0 0
13 39 1 0 0 0 0
13 59 1 0 0 0 0
14 15 1 0 0 0 0
14 19 1 6 0 0 0
14 40 1 0 0 0 0
15 16 1 0 0 0 0
15 41 1 0 0 0 0
17 18 1 0 0 0 0
17 22 2 0 0 0 0
18 24 2 0 0 0 0
19 42 1 0 0 0 0
19 43 1 0 0 0 0
19 44 1 0 0 0 0
20 23 1 0 0 0 0
20 46 1 0 0 0 0
20 47 1 0 0 0 0
21 25 1 0 0 0 0
22 29 1 0 0 0 0
22 48 1 0 0 0 0
23 27 1 0 0 0 0
24 30 1 0 0 0 0
24 49 1 0 0 0 0
25 50 1 0 0 0 0
25 51 1 0 0 0 0
26 28 1 0 0 0 0
27 31 1 0 0 0 0
27 33 2 0 0 0 0
28 32 1 0 0 0 0
28 52 1 0 0 0 0
29 30 2 0 0 0 0
29 53 1 0 0 0 0
30 54 1 0 0 0 0
31 35 2 0 0 0 0
32 55 1 0 0 0 0
32 56 1 0 0 0 0
32 57 1 0 0 0 0
33 37 1 0 0 0 0
33 58 1 0 0 0 0
34 60 1 0 0 0 0
34 61 1 0 0 0 0
34 62 1 0 0 0 0
35 38 1 0 0 0 0
35 63 1 0 0 0 0
36 64 1 0 0 0 0
36 65 1 0 0 0 0
36 66 1 0 0 0 0
37 38 2 0 0 0 0
37 67 1 0 0 0 0
38 68 1 0 0 0 0
39 69 1 0 0 0 0
39 70 1 0 0 0 0
39 71 1 0 0 0 0
M END
$$$$