0 mol 13 unq 0 iso 0 dist 7.44816 6.791 6.00107 7.42612 5.58571 8.27119 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.14945 5.6031 5.53102 10.6601 5.76052 5.72005 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 6.50337 8.7083 5.53102 11.0464 5.76052 5.72005 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.07553 5.11636 8.21811 9.30028 14.8484 7.7447 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.07553 4.79736 7.73513 11.6267 10.6188 8.85286 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 8.80127 13.6174 5.13078 13.6588 7.19357 7.7447 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.48457 5.11636 5.13078 9.30028 7.19357 7.7447 numMergedOcc 0
7 mol 30 unq 0 iso 0 dist 9.27081 11.2681 9.99577 15.767 9.23676 8.67216 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 9.18809 7.50975 6.33905 10.4695 10.6352 5.64092 numMergedOcc 0
9 mol 68 unq 1 iso 0 dist 9.18809 7.50975 6.33905 13.7382 5.29172 8.71074 numMergedOcc 0
10 mol 72 unq 0 iso 0 dist 4.69674 4.03844 7.52245 12.0815 15.3817 8.39955 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 5.62694 6.41115 8.31317 7.37171 10.9695 4.27766 numMergedOcc 0
12 mol 81 unq 0 iso 0 dist 7.19581 7.50394 9.08333 11.5303 5.89527 8.96045 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 9.61935 7.35297 5.97918 10.5813 4.52107 7.71625 numMergedOcc 0
14 mol 95 unq 0 iso 0 dist 8.82395 4.60151 9.55761 6.38004 5.08555 9.50709 numMergedOcc 0
15 mol 107 unq 0 iso 0 dist 7.02709 10.1994 6.71858 9.45682 3.35244 5.31375 numMergedOcc 0
16 mol 107 unq 1 iso 0 dist 7.02709 12.9752 9.37159 9.45682 3.35244 6.49371 numMergedOcc 0
17 mol 113 unq 0 iso 0 dist 5.82487 8.01602 6.03035 9.4359 4.62493 8.67025 numMergedOcc 0
18 mol 116 unq 0 iso 0 dist 8.10448 3.87365 9.02925 8.51123 4.89202 7.54274 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.83935 11.0961 7.54492 18.944 12.998 9.17458 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 9.83935 11.0961 7.54492 18.0284 11.8806 7.36794 numMergedOcc 0
21 mol 252 unq 0 iso 0 dist 6.38733 7.40852 9.03266 12.8652 10.9037 7.62991 numMergedOcc 0
22 mol 252 unq 1 iso 0 dist 6.38733 7.40852 9.03266 12.9602 13.3681 9.81261 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.29241 14.0303 9.62446 11.5975 3.39991 8.06767 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 9.29241 18.685 9.99681 11.5975 3.39991 9.91087 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.29241 14.0303 9.62446 11.5975 3.39991 8.06767 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 9.29241 18.685 9.99681 11.5975 3.39991 9.91087 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 9.29241 14.0303 9.62446 11.5975 3.39991 8.06767 numMergedOcc 0
28 mol 289 unq 1 iso 0 dist 9.29241 18.685 9.99681 11.5975 3.39991 9.91087 numMergedOcc 0
