ATOM 30
1 C1y C 25.6589 -21.2591
2 C1y C 25.6589 -22.6251
3 C1x C 26.8420 -23.3081
4 C1y C 28.0249 -22.6251
5 C1z C 28.0249 -21.2591
6 C1x C 26.8420 -20.5762
7 C1x C 29.2078 -23.3081
8 C1x C 30.3908 -22.6251
9 C1y C 30.3908 -21.2591
10 C1y C 29.2078 -20.5762
11 C1y C 31.5738 -20.5762
12 C1z C 31.5738 -19.2102
13 C1x C 30.3908 -18.5272
14 C1x C 29.2078 -19.2102
15 C1x C 33.9397 -20.5762
16 C1x C 33.9397 -19.2102
17 C1y C 32.7567 -18.5272
18 N1y N 24.4760 -20.5762
19 C1a C 28.0267 -19.8932
20 O1a O 24.4760 -23.3081
21 C1a C 31.5781 -17.8443
22 C5a C 32.7567 -17.1613
23 C1b C 33.9436 -16.4760
24 O5a O 31.5778 -16.4806
25 C1x C 24.4760 -19.1821
26 C1x C 23.2633 -18.4819
27 O2x O 22.0505 -19.1820
28 C1x C 22.0505 -20.5761
29 C1x C 23.2632 -21.2763
30 X Cl 35.1495 -17.1720
BOND 34
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 1 18 1 #Up
22 5 19 1 #Up
23 2 20 1 #Down
24 12 21 1 #Up
25 17 22 1
26 22 23 1
27 22 24 2
28 18 25 1
29 25 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 18 29 1
34 23 30 1
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