ATOM 29
1 N1a N 17.2367 -16.1848
2 C2c C 18.4504 -15.4841
3 N1b N 19.6643 -16.1848
4 C1b C 20.8780 -15.4841
5 C1b C 22.0917 -16.1848
6 C1b C 23.3056 -15.4841
7 C1c C 24.5193 -16.1848
8 C5a C 25.7330 -15.4841
9 N1b N 26.9469 -16.1848
10 C8y C 28.1606 -15.4841
11 N2a N 18.4504 -14.0827
12 O5a O 25.7330 -14.0826
13 C8x C 29.3805 -16.1883
14 C8x C 30.5942 -15.4876
15 C8y C 30.5943 -14.0860
16 C8x C 29.3745 -13.3817
17 C8x C 28.1606 -14.0825
18 N2b N 31.8299 -13.3725 #+
19 O3a O 33.0347 -14.0681 #-
20 O3a O 31.8296 -11.9803
21 N1b N 24.5193 -17.5864
22 C5a C 23.3096 -18.2848
23 O5a O 22.1148 -17.5948
24 C8y C 23.3095 -19.6885
25 C8x C 22.1137 -20.3789
26 C8x C 22.1138 -21.7805
27 C8x C 23.3275 -22.4813
28 C8x C 24.5234 -21.7907
29 C8x C 24.5233 -20.3892
BOND 30
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 2 11 2
11 8 12 2
12 10 13 2
13 13 14 1
14 14 15 2
15 15 16 1
16 16 17 2
17 10 17 1
18 15 18 1
19 18 19 1
20 18 20 2
21 7 21 1 #Down
22 21 22 1
23 22 23 2
24 22 24 1
25 24 25 1
26 25 26 2
27 26 27 1
28 27 28 2
29 28 29 1
30 24 29 2
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