0 mol 64 unq 0 iso 0 dist 9.86958 9.99634 10.8691 8.21081 12.174 9.80142 11.6323 9.82635 9.54144 6.23335 numMergedOcc 0
1 mol 64 unq 0 iso 1 dist 9.86958 9.99634 10.8691 11.6323 9.82635 9.54144 8.21081 12.174 9.80142 6.23335 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.36667 8.24121 14.9981 6.51655 14.7243 7.04352 15.9496 21.1392 8.1114 14.4772 numMergedOcc 0
3 mol 69 unq 0 iso 1 dist 8.36667 8.24121 14.9981 15.9496 21.1392 8.1114 6.51655 14.7243 7.04352 14.4772 numMergedOcc 0
4 mol 87 unq 0 iso 0 dist 9.10245 5.26938 5.39287 7.62644 12.6881 7.51358 10.8096 11.2241 8.93296 8.12939 numMergedOcc 0
5 mol 87 unq 0 iso 1 dist 9.10245 5.26938 5.39287 10.8096 11.2241 8.93296 7.62644 12.6881 7.51358 8.12939 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.24549 6.85677 5.19198 9.87733 13.9827 9.80862 11.7378 12.9568 8.43904 4.84196 numMergedOcc 0
7 mol 119 unq 0 iso 1 dist 8.24549 6.85677 5.19198 11.7378 12.9568 8.43904 9.87733 13.9827 9.80862 4.84196 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 7.9663 9.05626 9.97628 5.53247 10.7605 6.89257 8.63186 15.0759 8.74308 6.09983 numMergedOcc 0
9 mol 130 unq 0 iso 1 dist 7.9663 9.05626 9.97628 8.63186 15.0759 8.74308 5.53247 10.7605 6.89257 6.09983 numMergedOcc 0
10 mol 218 unq 0 iso 0 dist 9.86417 9.88212 9.38348 13.5954 15.2122 7.18041 12.7227 15.6702 7.17547 9.17818 numMergedOcc 0
11 mol 218 unq 0 iso 1 dist 9.86417 9.88212 9.38348 12.7227 15.6702 7.17547 13.5954 15.2122 7.18041 9.17818 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 10.4277 10.4686 6.84247 12.6281 10.0817 6.99002 11.5311 numMergedOcc 0
13 mol 220 unq 0 iso 1 dist 7.86207 8.9077 4.90657 12.6281 10.0817 6.99002 10.4277 10.4686 6.84247 11.5311 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 7.62593 4.79841 5.41021 5.64308 10.8214 7.06793 7.32238 6.4508 6.67585 6.88258 numMergedOcc 0
15 mol 224 unq 0 iso 1 dist 7.62593 4.79841 5.41021 7.32238 6.4508 6.67585 5.64308 10.8214 7.06793 6.88258 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 6.91184 6.095 5.0258 5.17887 9.73006 5.86443 5.52229 9.69775 7.22914 5.76653 numMergedOcc 0
17 mol 227 unq 0 iso 1 dist 6.91184 6.095 5.0258 5.52229 9.69775 7.22914 5.17887 9.73006 5.86443 5.76653 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.74214 8.89538 10.4952 13.2905 14.0108 6.77463 10.4286 15.4111 7.2766 10.9258 numMergedOcc 0
19 mol 238 unq 0 iso 1 dist 6.74214 8.89538 10.4952 10.4286 15.4111 7.2766 13.2905 14.0108 6.77463 10.9258 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 5.33462 8.89538 7.22173 13.2905 9.75691 6.77463 10.4286 11.8665 7.2766 10.9258 numMergedOcc 0
21 mol 238 unq 1 iso 1 dist 5.33462 8.89538 7.22173 10.4286 11.8665 7.2766 13.2905 9.75691 6.77463 10.9258 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 7.50321 6.62923 7.55961 6.99865 12.5113 9.09992 10.3424 13.6844 6.16449 9.75529 numMergedOcc 0
23 mol 272 unq 0 iso 1 dist 7.50321 6.62923 7.55961 10.3424 13.6844 6.16449 6.99865 12.5113 9.09992 9.75529 numMergedOcc 0
24 mol 272 unq 1 iso 0 dist 9.61597 6.62923 5.43733 6.99865 12.8442 9.09992 10.3424 11.1067 6.16449 9.75529 numMergedOcc 0
25 mol 272 unq 1 iso 1 dist 9.61597 6.62923 5.43733 10.3424 11.1067 6.16449 6.99865 12.8442 9.09992 9.75529 numMergedOcc 0
