0 mol 7 unq 0 iso 0 dist 7.15434 7.29541 5.72491 11.9621 12.2041 7.88043 13.6482 7.12508 8.15894 12.8323 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 7.51406 6.81213 5.69955 14.9006 9.78225 8.6385 12.4917 8.25132 6.73167 7.73394 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 7.51406 6.81213 5.69955 14.9006 9.78225 8.6385 10.483 4.94205 7.40948 7.42064 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.17086 8.33667 9.93832 10.615 8.13395 8.60739 13.0289 10.8828 7.24352 5.07458 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 8.99949 14.8405 9.29384 21.5913 13.2572 9.15431 19.8448 12.6005 6.78801 4.57579 numMergedOcc 0
5 mol 131 unq 1 iso 0 dist 8.99949 14.8405 9.29384 15.0798 6.63273 6.92648 19.8448 12.6005 6.78801 8.57203 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 7.34465 7.97183 6.69515 9.47675 6.21253 7.86572 13.7901 13.2918 6.77921 13.4066 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 9.47675 7.97183 7.86572 7.34465 6.21253 6.69515 13.7901 13.4066 6.77921 13.2918 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 7.13441 6.15895 5.10618 12.2067 7.31409 7.71426 13.2972 13.9189 9.13027 11.8244 numMergedOcc 0
9 mol 171 unq 1 iso 0 dist 7.13441 6.15895 5.10618 14.894 13.7214 9.86681 13.2972 13.9189 9.13027 8.25926 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 8.3705 9.80071 7.62942 15.8199 10.7531 6.60567 12.5713 6.04871 6.34234 5.41635 numMergedOcc 0
11 mol 195 unq 1 iso 0 dist 8.3705 9.80071 7.62942 15.8199 10.7531 6.60567 10.6913 8.04534 7.87972 11.9954 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 9.47932 14.3725 6.29767 10.4861 4.12932 8.57827 13.1493 3.9436 5.50658 6.47488 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 8.7419 7.26742 7.862 15.7704 10.5806 9.2581 11.2674 8.84507 7.97027 9.01393 numMergedOcc 0
14 mol 222 unq 1 iso 0 dist 8.7419 7.26742 7.862 15.7704 10.5806 9.2581 12.7466 8.67203 6.81955 6.25425 numMergedOcc 0
15 mol 222 unq 2 iso 0 dist 8.7419 7.26742 7.862 15.7704 10.5806 9.2581 10.656 6.02502 4.9876 5.64455 numMergedOcc 0
16 mol 222 unq 3 iso 0 dist 8.7419 7.26742 7.862 12.9952 6.9154 9.62632 11.2674 8.84507 7.97027 13.3586 numMergedOcc 0
17 mol 222 unq 4 iso 0 dist 8.7419 7.26742 7.862 12.9952 6.9154 9.62632 12.7466 8.67203 6.81955 5.16212 numMergedOcc 0
18 mol 222 unq 5 iso 0 dist 8.7419 7.26742 7.862 12.9952 6.9154 9.62632 10.656 6.02502 4.9876 5.9478 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 9.60159 11.2986 8.38865 12.0857 5.22356 5.4694 10.4038 4.1511 5.28771 4.69247 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.8902 5.86656 6.14323 9.5903 4.92077 6.04162 11.1879 13.2035 7.14086 11.4167 numMergedOcc 0
21 mol 276 unq 0 iso 0 dist 8.54938 5.38576 7.88706 11.8795 10.6102 6.70215 11.3123 9.33434 7.49391 4.51728 numMergedOcc 0
22 mol 276 unq 1 iso 0 dist 8.54938 5.38576 7.88706 11.2326 6.19843 7.25423 11.3123 9.33434 7.49391 5.45206 numMergedOcc 0
23 mol 276 unq 2 iso 0 dist 8.54938 5.38576 7.88706 11.2314 12.4616 7.23916 11.3123 9.33434 7.49391 12.2368 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 7.58272 12.325 7.67245 13.0289 5.74345 9.12395 20.2022 13.5923 8.63072 10.9571 numMergedOcc 0
25 mol 278 unq 1 iso 0 dist 7.58272 12.325 7.67245 13.0289 5.74345 9.12395 16.8764 10.0918 7.59696 6.48173 numMergedOcc 0
