0 mol 18 unq 0 iso 0 dist 5.03976 8.35401 6.44368 10.3745 8.80193 7.60512 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.36326 8.26412 7.1845 4.93307 9.71382 6.29797 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 5.77643 5.51172 4.22398 4.4218 8.90835 6.88052 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 7.13638 8.26586 4.39445 4.35705 7.6481 7.58739 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 7.13638 9.76234 10.7557 4.35705 7.6481 9.01564 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 9.62096 8.52697 17.0218 12.6241 21.7624 9.77084 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 7.93317 8.52697 13.5391 12.6241 18.9492 9.77084 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 7.11013 8.52697 4.1859 12.6241 9.63599 9.77084 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 7.46478 6.24296 7.2898 4.32784 6.05495 5.05893 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 7.46478 6.83218 4.13305 4.32784 6.05495 5.71866 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 5.77804 9.43355 12.1673 17.826 21.3303 9.19977 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 5.77804 9.43355 12.1673 16.0131 18.9091 7.28831 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 5.77804 9.43355 12.1673 11.7408 17.0156 9.71411 numMergedOcc 0
13 mol 141 unq 0 iso 0 dist 6.96294 5.24228 6.37052 4.46354 5.52683 7.58337 numMergedOcc 0
14 mol 141 unq 1 iso 0 dist 9.71611 4.54218 6.8823 4.37003 11.232 5.92302 numMergedOcc 0
15 mol 141 unq 2 iso 0 dist 9.71611 4.54218 6.8823 4.34943 11.7894 5.29898 numMergedOcc 0
16 mol 141 unq 3 iso 0 dist 7.1093 4.54218 4.22522 4.37003 9.40594 5.92302 numMergedOcc 0
17 mol 141 unq 4 iso 0 dist 7.1093 4.54218 4.22522 4.34943 5.26989 5.29898 numMergedOcc 0
18 mol 141 unq 5 iso 0 dist 7.36421 8.36316 4.22522 9.86195 9.40594 5.92302 numMergedOcc 0
19 mol 141 unq 6 iso 0 dist 7.36421 8.36316 4.22522 4.50791 5.26989 5.29898 numMergedOcc 0
20 mol 146 unq 0 iso 0 dist 9.39237 9.48545 5.93846 4.43511 6.50043 9.23136 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 7.63085 6.68721 9.88872 6.83901 12.3466 9.97968 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 7.82604 9.19831 5.08641 6.15536 10.2746 8.59681 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 8.22583 9.19831 10.9122 6.15536 5.97685 8.59681 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 6.62037 7.83476 4.48306 4.19412 5.97685 8.12266 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 6.21461 7.83476 4.88823 4.19412 8.9289 8.12266 numMergedOcc 0
26 mol 218 unq 0 iso 0 dist 8.03194 5.4767 10.1772 8.23548 15.2093 8.57119 numMergedOcc 0
