0 mol 11 unq 0 iso 0 dist 6.09937 5.25951 9.08736 4.73237 8.68293 7.86896 6.89666 7.28643 9.23212 4.61088 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.07476 10.5382 9.74528 5.8961 6.84216 7.86896 10.2486 9.68636 9.23212 4.61088 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.4515 13.3961 7.02693 3.97569 6.23522 10.8067 11.3877 4.73407 10.392 9.38498 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.4515 13.3961 7.02693 12.4903 9.10566 6.58444 10.7935 3.85805 4.24428 5.93252 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.4515 9.15529 8.58248 3.97569 6.23522 7.9573 11.3877 4.73407 7.01889 9.38498 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.4515 9.15529 8.58248 12.4903 9.10566 17.249 10.7935 3.85805 12.424 5.93252 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.46582 4.00834 5.91098 8.78063 7.61521 10.2219 6.4551 3.69293 4.83274 6.97941 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 6.46582 9.6911 4.86523 8.78063 7.61521 7.74851 6.4551 3.69293 7.89214 6.97941 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 7.74924 10.0189 9.02905 5.77535 7.51733 4.33346 11.5827 4.73066 8.26838 9.03572 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 7.74924 10.0189 9.02905 9.35848 9.01607 7.47119 11.5827 4.73066 8.26838 8.83255 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 6.80798 6.25432 4.821 4.42285 4.42563 6.28781 9.69426 7.90729 11.9171 8.37808 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 7.84813 5.0466 4.4077 5.56946 7.97548 4.80675 13.5311 12.5321 10.1938 8.54584 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 7.84813 5.0466 4.4077 6.4379 9.9291 5.57362 13.5311 12.5321 10.1938 8.53613 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 4.82356 8.75242 9.35049 4.84607 5.78814 13.1243 9.3894 6.12885 15.4604 6.5107 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 8.83476 6.45333 9.35049 11.981 5.78814 13.1243 14.1938 6.12885 15.4604 6.5107 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 8.95296 5.4173 8.06817 6.32863 5.36671 8.88239 12.2455 12.8624 15.9047 9.87651 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 6.10021 6.56771 8.06817 5.48405 5.36671 8.88239 15.1956 12.8624 15.9047 9.87651 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 8.93485 11.2438 8.83628 4.2475 9.31158 14.3203 13.2057 10.8636 19.1456 9.61492 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.93485 11.2438 8.83628 4.2475 9.31158 14.3203 6.752 5.42503 10.8734 7.45763 numMergedOcc 0
19 mol 205 unq 2 iso 0 dist 5.66636 7.47443 8.83628 6.8901 9.31158 14.3203 13.3164 10.8636 19.1456 9.61492 numMergedOcc 0
20 mol 205 unq 3 iso 0 dist 5.66636 7.47443 8.83628 6.8901 9.31158 14.3203 5.4913 5.42503 10.8734 7.45763 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 9.68612 17.6762 9.46274 5.67031 9.06459 14.5108 10.961 4.15355 9.4835 8.82096 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 8.71119 9.53082 6.3093 11.8779 9.19385 4.84708 9.1566 5.85692 7.80525 7.32223 numMergedOcc 0
23 mol 253 unq 1 iso 0 dist 8.71119 9.53082 6.3093 11.8779 9.19385 4.84708 14.0212 6.0222 7.71295 8.31064 numMergedOcc 0
24 mol 253 unq 2 iso 0 dist 8.71119 9.53082 6.3093 15.4152 9.1927 6.27022 14.0212 6.0222 7.71295 6.73034 numMergedOcc 0
