0 mol 13 unq 0 iso 0 dist 9.06342 4.8899 7.42612 10.137 8.59991 6.79244 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.7649 17.7515 8.23075 14.2346 7.18124 7.6222 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.7649 17.7515 8.23075 6.7213 8.10168 14.8593 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.5268 14.2153 8.23075 11.9263 7.18124 7.6222 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.5268 14.2153 8.23075 3.83179 8.10168 14.8593 numMergedOcc 0
5 mol 81 unq 0 iso 0 dist 4.95504 4.35132 5.51927 6.17229 5.70283 8.57859 numMergedOcc 0
6 mol 81 unq 1 iso 0 dist 4.95504 4.35132 5.51927 8.36931 7.16741 11.453 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 9.27814 13.4816 9.01812 7.18472 7.67463 6.62562 numMergedOcc 0
8 mol 111 unq 0 iso 0 dist 5.53271 4.41283 5.98809 6.02783 7.24101 6.3561 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 5.56598 5.6257 7.53694 7.947 9.8098 10.885 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 5.39792 5.0256 7.53694 6.36542 9.8098 10.885 numMergedOcc 0
11 mol 120 unq 2 iso 0 dist 7.00542 8.66137 7.53694 5.1941 9.8098 10.885 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 8.06631 11.5024 8.57739 8.83242 9.0745 10.872 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 8.94352 6.97147 6.73617 15.6431 9.28718 9.58148 numMergedOcc 0
14 mol 167 unq 0 iso 0 dist 8.0697 9.37794 5.36671 5.78025 7.33178 8.09332 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 6.3472 4.51874 4.72821 4.4872 6.53017 4.43082 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 7.42696 13.0751 8.95136 15.1198 9.39795 9.72283 numMergedOcc 0
17 mol 184 unq 1 iso 0 dist 7.42696 13.0751 8.95136 6.47176 7.33424 8.34086 numMergedOcc 0
18 mol 184 unq 2 iso 0 dist 7.42696 13.0751 8.95136 7.88594 8.04472 13.3799 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 4.42095 10.8182 9.38984 10.9163 8.93352 11.9992 numMergedOcc 0
20 mol 194 unq 1 iso 0 dist 4.42095 10.0354 9.91118 10.9163 8.93352 15.2884 numMergedOcc 0
21 mol 194 unq 2 iso 0 dist 4.63898 7.58286 9.38984 6.28634 8.93352 11.9992 numMergedOcc 0
22 mol 194 unq 3 iso 0 dist 4.63898 9.53373 9.91118 6.28634 8.93352 15.2884 numMergedOcc 0
23 mol 194 unq 4 iso 0 dist 9.53641 10.4127 9.38984 17.7577 8.93352 11.9992 numMergedOcc 0
24 mol 194 unq 5 iso 0 dist 9.53641 7.1015 9.91118 17.7577 8.93352 15.2884 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 5.65735 4.41663 8.40074 6.77967 9.57433 4.04791 numMergedOcc 0
26 mol 252 unq 0 iso 0 dist 5.2116 4.52914 8.55044 7.95139 8.63893 5.8401 numMergedOcc 0
27 mol 266 unq 0 iso 0 dist 7.43884 9.65978 9.29666 5.7413 7.24165 11.0673 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 9.89615 15.8358 8.12739 16.53 8.87546 12.292 numMergedOcc 0
29 mol 274 unq 1 iso 0 dist 5.77565 4.68199 8.12739 10.359 8.87546 12.292 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 9.14217 7.17634 5.30118 7.76761 9.97939 7.57364 numMergedOcc 0
31 mol 287 unq 1 iso 0 dist 9.14217 7.78985 8.98698 7.76761 9.97939 3.99731 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 9.14217 7.17634 5.30118 7.76761 9.97939 7.57364 numMergedOcc 0
33 mol 288 unq 1 iso 0 dist 9.14217 7.78985 8.98698 7.76761 9.97939 3.99731 numMergedOcc 0
34 mol 289 unq 0 iso 0 dist 9.14217 7.17634 5.30118 7.76761 9.97939 7.57364 numMergedOcc 0
35 mol 289 unq 1 iso 0 dist 9.14217 7.78985 8.98698 7.76761 9.97939 3.99731 numMergedOcc 0
36 mol 294 unq 0 iso 0 dist 7.58948 9.41638 8.88595 14.3928 9.255 10.3494 numMergedOcc 0
