0 mol 26 unq 0 iso 0 dist 5.73363 10.009 6.12361 14.5019 10.6118 8.82012 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.76585 12.7554 8.03754 14.5682 10.1053 9.83618 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 8.6338 6.16737 8.44473 12.9951 10.8911 8.76003 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 7.31677 4.90701 8.44473 11.0903 10.8911 8.76003 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.33989 11.9403 7.46657 14.6648 6.14439 6.21982 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 8.57953 9.03147 7.46657 12.6331 6.14439 6.21982 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.73946 6.75472 7.9258 13.1716 10.8105 7.76729 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 7.82249 6.7814 9.32858 8.78982 5.13173 7.20326 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.56319 14.4095 9.47554 15.7784 6.61857 7.92688 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 9.73038 5.37072 9.47554 11.5756 6.61857 7.92688 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 5.47265 6.91778 9.88662 11.9074 10.9183 8.33261 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.66811 13.3909 8.41774 19.8133 10.8622 9.13561 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 8.02356 5.01007 8.57712 8.02593 6.6805 7.39644 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 8.02356 5.01007 8.57712 12.3723 11.3672 7.70572 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 5.13534 4.3226 7.7544 5.83596 5.20775 4.93785 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 9.35664 8.95444 7.04524 16.9869 10.9358 8.36117 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 9.35664 8.95444 7.04524 13.5753 7.60158 6.77578 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 9.51001 4.15973 7.87233 6.98151 4.71339 5.34718 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 8.48816 14.2691 7.73213 14.4107 6.83816 6.83797 numMergedOcc 0
19 mol 276 unq 0 iso 0 dist 9.57019 6.08754 7.85804 14.2918 7.32389 9.38971 numMergedOcc 0
