0 mol 0 unq 0 iso 0 dist 7.55723 8.82652 5.56852 4.53161 6.44948 8.27602 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 6.66589 7.88748 4.90612 4.70233 9.71908 12.2723 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.05728 6.34215 9.49478 11.2948 9.18371 15.8609 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.62769 9.87963 4.02037 9.80109 5.38191 8.8015 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 6.09782 8.67352 4.02037 8.65318 5.38191 8.8015 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 6.46655 7.80026 6.08003 6.55138 6.48625 11.5247 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.89021 7.69222 15.8457 14.4661 9.02288 16.622 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.89021 7.69222 15.8457 18.6603 9.58544 22.9272 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 9.89021 5.82056 14.3818 14.4661 9.02288 15.8937 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 9.89021 5.82056 14.3818 18.6603 9.58544 21.722 numMergedOcc 0
10 mol 73 unq 4 iso 0 dist 9.89021 9.09115 16.9684 14.4661 9.02288 18.3832 numMergedOcc 0
11 mol 73 unq 5 iso 0 dist 9.89021 9.09115 16.9684 18.6603 9.58544 23.7784 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 8.93552 9.03339 9.38943 11.6665 6.86946 15.577 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 5.44596 8.4449 5.65439 8.91817 9.93572 14.8427 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 8.90592 9.70788 11.903 7.13388 5.46922 13.1485 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 7.30244 8.63649 14.9028 11.8854 8.48112 16.3794 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 7.34316 7.5808 5.30405 6.5658 7.82697 10.9498 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 6.73134 9.67162 4.66414 10.1358 8.77254 6.92437 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 9.67877 9.6327 6.95359 9.0655 5.73296 11.455 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.54753 8.66133 4.24707 4.62586 8.90885 10.2471 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 6.54753 6.95569 12.634 4.62586 8.90885 5.63226 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 5.17586 7.03656 8.4236 5.72978 8.13489 8.16952 numMergedOcc 0
